0 int64 0 1.32k | ocr stringlengths 5 1.85k | caption stringlengths 50 2.54k | image imagewidth (px) 225 5.4k |
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0 | ['MeC', 'Me', 'HOC', 'PdCI2(PPh3)2(5% mol),', 'Ph', 'ph', 'CHO', 'TFE/EtOH 1:1', 'HCO2H (1 eq)', 'NH2', '30C,24 h', 'MeCN/Et3N 1:1', 'tBu-NC', 'BI', '85C,18h', 'MeO', 'OMe', '1 (83%)', 'work up and crystallization', '-', 'Ph', 'PH', 'OHMeCN,DBU', 'TFA/CHCl2', 'OMe', 'r.t., 4 h', '1:2, r.t., 2 h', 'VF', 'OMe', 'ISO-1 (6... | {'Ugi reaction': [{'substrate': ['MeC', 'Me', 'HOC', 'PdCI2(PPh3)2(5% mol)', 'Ph', 'ph', 'CHO', 'TFE/EtOH 1:1'], 'products': ['NH2', 'HCO2H (1 eq)', 'MeO', 'OMe', '1 (83%)']}], 'Reductive Heck reaction': [{'substrate': ['1 (83%)'], 'products': ['MeCN/Et3N 1:1', 'tBu-NC', 'BI', '85C,18h', '2 (Z/E 10:1)']}], 'Aromatizati... | |
1 | ['2 mol%Pd(OAc)2', '4 mol% SPhos', 'Ar(Het-X', 'ZnI*LiCI', 'THF.25C,16 h', '(Het)Ar', 'X=I,BrCI', '4a', '5a-l:73-98%[a]', '1.0 equiv', '1.2 equiv', 'OMe', 'COE', '5a:98%X=Br', '5b95%X=I', '5c83%,X=I', '5d97%X=l', '5e85%X=', '5f:83%X=Br', '5g:95%X=CI', '5h90%,X=Br', '4 mol% Pd(PPh3)4', 'ZnI*LiCI', 'THF.25C or 50C.16 h',... | {'Pd(OAc)2': [{'substrate': ['Ar(Het-X', 'ZnI*LiCI'], 'products': ['5a-l:73-98%[a]']}], 'SPhos': [{'substrate': ['Ar(Het-X', 'ZnI*LiCI'], 'products': ['5a-l:73-98%[a]']}], 'Pd(PPh3)4': [{'substrate': ['ZnI*LiCI'], 'products': ['5i-I73-87%[a]']}]} | |
2 | ['ZnI LiCl', '2 mol% Pd(OAc)2', 'Ar-X', '4 mol%SPhos', 'THF,25C,16 h', 'X=BrI', '4b-e', '6-9:75-99%[a]', '1.0 equiv', '1.2 equiv', 'Me', 'Me', 'Me', 'OMe', 'COMe', '(S-6a 83%,>95% ee', 'R)-6b 86%,98% ee', 'R)-6c 91%98% ee', 'M', 'OMe', 'NH', '(S)-6d 99%99%ee', 'S)-7a 93%,99% ee', '(S)-7b 89%,99%ee', '-', 'CHO', 'S)-7c ... | {'ZnI LiCl': [{'substrate': ['Ar-X', '4b-e'], 'products': ['6-9:75-99%[a]']}], '2 mol% Pd(OAc)2': [{'substrate': ['Ar-X', '4b-e'], 'products': ['6-9:75-99%[a]']}], '4 mol%SPhos': [{'substrate': ['Ar-X', '4b-e'], 'products': ['6-9:75-99%[a]']}], 'THF,25C,16 h': [{'substrate': ['Ar-X', '4b-e'], 'products': ['6-9:75-99%[a... | |
3 | ['[a] 4 moI% Pd(PPh3)4', 'ZnI-LiCl', 'THF,25or 50C,16 h', '[b] 10 mol% Cul', '4b-e', 'THF,0-25C16h', '6-9:66-86%[c]', '1.0 equiv', '1.2 equiv', 'R)-6e 73%[bl,99% ee', 'R)-6f 67%[b],99% ee', 'R)-6g 79%lb),99% ee', 'OMe', 'Me', 'R)-6h 59%bl,99% ee', 'S-7f85%[a],99%ee', 'S)-7g 80%(b], 99% ee', 'OEt', '(S)-7h 70%(bl, 99% e... | {'Pd(PPh3)4': [{'substrate': ['4b-e', 'R)-6e', 'R)-6f', 'R)-6g', 'R)-6h', 'S-7f', 'S)-7g', 'S)-7h', 'S)-7i', 'S)-7j', 'S)-8e', 'S-8f', 'R-8f', 'S)-8g', 'S)-8h', 'S)-9f'], 'products': ['OMe', 'Me', 'OEt', 'COEt']}], 'CuI': [{'substrate': ['4b-e', 'R)-6e', 'R)-6f', 'R)-6g', 'R)-6h', 'S-7f', 'S)-7g', 'S)-7h', 'S)-7i', 'S)... | |
4 | ['MeO', 'OMe', 'Mel 3 equiv)', 'NaBH4', 'OH', 'NaOAc', 'KOH(3 equiv', '1.5 equiv', 'L-tyrosine', 'DCE/HO/AcOH', 'DMF,0-25C', 'EtOH,0-25C', 'MeO', '90C,16 h', '24 h', '4 h', 'S)-2g:40%,3 steps', 'PPh3,limidazole1.1 equiv', 'DCM,0-25C,3h', 'Zn (1.5 equiv)', 'ZnI LiCl', 'LiCi (1.0 equiv)', 'MeO', 'MeO', 'R-X', 'MeO', 'THF... | {'NaBH4': [{'substrate': ['MeO'], 'products': ['OH']}], 'NaOAc': [{'substrate': ['OH'], 'products': ['MeO']}], 'KOH': [{'substrate': ['MeO'], 'products': ['MeC']}], 'PPh3/limidazole': [{'substrate': ['MeC'], 'products': ['MeO']}], 'Zn': [{'substrate': ['MeO'], 'products': ['S-3g']}], 'LiCl': [{'substrate': ['S-3g'], 'p... | |
5 | ['Eriodictyol', 'Naringenin', "3'-Me-E", "3'4'-DiMe-E", 'Product 3', '7-Me-N', 'Product2', '100', '100', '75', '75', 'Area1%', '50', '25', '25', 'leOMTT133M', 'T133M T133M T133M T133M T133M T133M', 'leOMTT133M', 'T133M T133M T133M T133M T133M T133M', 'L322H L322N L322M Y326H Y326R Y326L', 'L322HL322NL322M Y326H Y326RY3... | {'IeOMT': [{'substrate': ['Eriodictyol', 'Naringenin'], 'products': ["3'-Me-E", "3'4'-DiMe-E", '7-Me-N']}, {'substrate': ['Luteolin'], 'products': ["3'-Me-L", "3',4'-DiMe-L"]}, {'substrate': ['Quercetin'], 'products': ["3'-Me-Q", "3'4'-DiMe-Q"]}, {'substrate': ['Genistein'], 'products': ['7-Me-G', "4'-Me-G"]}], 'IeOMT ... | |
6 | ['SeO', 've', 'Br', 'Me', '1,4-dioxane', "100 'C,56 h", '18g', '76%', '24', 'MeO?', '(CO,Me)CH,ZnBr', 'Me', 'THF', 'rt, 1 h', '19g', '99%', '25', 'MeS', 'RuCl3 NaIO4', 'MeC', 'MeCN,CCI4 H2O', 'rt, 75 min', '19g', '26', '92%'] | {'SeO2': [{'substrate': ['18g'], 'products': ['24']}], '(CO,Me)CH,ZnBr': [{'substrate': ['19g'], 'products': ['25']}], 'RuCl3 NaIO4': [{'substrate': ['19g'], 'products': ['26']}]} | |
7 | ['5 mol-% 8/Ti(OiPr)4', 'TMSCN', 'NC', 'OBn', 'OBn', 'CHCl2,-20C', 'OTMS', '.', '75% yield,80% ee', '10', '1HCI in EtOH,89% yield', '2)MeONHMe.HCI', 'MeO', 'iPrMgCI,84% yield', 'OBn', 'Amphidinolides', '3)DMSO,AcOH', 'G and H', 'OTMS', 'AcO60% yield', '11'] | {'8/Ti(OiPr)4': [{'substrate': ['TMSCN', 'NC', 'OBn', 'OBn', 'CHCl2', 'OTMS'], 'products': ['OBn', 'Amphidinolides', 'G and H', 'OTMS']}], 'MeONHMe.HCI': [{'substrate': ['OBn'], 'products': ['1HCI in EtOH']}], 'iPrMgCI': [{'substrate': ['1HCI in EtOH'], 'products': ['MeO', 'OBn']}], 'DMSO,AcOH': [{'substrate': ['MeO', ... | |
8 | ['R-YLB10 mol-%', 'HO(30 mol-%).nBuLi(10 mol-%', 'OCOEt', '[2,6-CHOCgH3]3PO10mol-%)', 'CN', '62', 'THF.-78C.5h', '63', '92% yield,87% ee', '1.2,4-CICgH3', 'OCOEt', 'CN', '190C,6 h', 'OH', '64', '(+)-patulolideC'] | {'R-YLB': [{'substrate': ['HO', '[2,6-CHOCgH3]3PO', 'nBuLi'], 'products': ['OCOEt', 'CN', '62']}], 'nBuLi': [{'substrate': ['62'], 'products': ['THF.-78C.5h', '63']}], '[2,6-CHOCgH3]3PO': [{'substrate': ['63'], 'products': ['92% yield,87% ee', '1.2,4-CICgH3', 'OCOEt']}], 'CN': [{'substrate': ['1.2,4-CICgH3'], 'products... | |
9 | ['[MCI4]2', '+MCInHO', '2-Propanol/HCI', '60 min,110', 'CI', 'M=Cu,Co,Mnx=0.25,0.50,0.75', 'Monometallic:M=Cu,Co.Mn', 'Ma1-/Mbx', 'Bimetallic:', 'Trimetallic:', 'M0.33/Mb0.33/M0.33'] | {'MCI4': [{'substrate': ['2-Propanol/HCI'], 'products': ['Monometallic:M=Cu,Co.Mn', 'Bimetallic:', 'Trimetallic:', 'M0.33/Mb0.33/M0.33']}]} | |
10 | ['NH3*', 'NH3*', 'HO', '+ 2H++ 2e', 'Serotonin', 'Tryptamine-4,5-dione'] | {'NH3*': [{'substrate': ['Serotonin'], 'products': ['Tryptamine-4,5-dione', 'HO']}], '+ 2H++ 2e': [{'substrate': ['Serotonin'], 'products': ['Tryptamine-4,5-dione', 'NH3*']}]} | |
11 | ['DOPA', 'L-Tyrosine', 'Tyrosine', 'Dihydroxyphenylalanine', 'Doapamine', 'hydroxylase', '(DOPA)', 'decarboxylase', '(DA)', 'Phenylethanolamine-N-', 'Dopamine -hydroxylase', 'Epinephrine (EP)', 'Norepinephrine (NE)', 'methyltransferase'] | {'Dopamine-β-hydroxylase': [{'substrate': ['DOPA', 'Dihydroxyphenylalanine', 'Doapamine'], 'products': ['Norepinephrine (NE)']}], 'Phenylethanolamine-N-methyltransferase': [{'substrate': ['Norepinephrine (NE)'], 'products': ['Epinephrine (EP)']}], 'DOPA decarboxylase': [{'substrate': ['L-Tyrosine', 'Tyrosine'], 'produc... | |
12 | ['NH2', '-4H+,-4e', 'H', 'H', 'Histamine', '2-(1H-Imidazol-4-yl)acetonitrile'] | {'NH2': [{'substrate': ['Histamine'], 'products': ['2-(1H-Imidazol-4-yl)acetonitrile']}], '-4H+,-4e': [{'substrate': ['Histamine'], 'products': ['2-(1H-Imidazol-4-yl)acetonitrile']}]} | |
13 | ['HC', 'HC', 'CH', '+HO', '+ CHCOOH', 'H3', 'HC', 'CH3', 'CH3', 'ACh', 'Choline'] | {'Acetylcholine Esterase': [{'substrate': ['Acetylcholine'], 'products': ['Choline', 'Acetic Acid']}], 'Choline Oxidase': [{'substrate': ['Choline'], 'products': ['Acetic Acid']}]} | |
14 | ['a', 'UV light', 'NF', 'b)', ':m', 'UV light', 'peel off', 'm m', 'm m', 'MOF', 'monomer', 'photoinitiator', '0', 'mould', 'MOF', 'stand-alone', 'monomer', 'peel off', 'UV light'] | {'Postsynthetic polymerisation (PSP)': [{'substrate': ['UiO-66-NH2', 'methacrylic anhydride', 'butyl methacrylate (BMA)', 'phenylbis(2,4,6-trimethylbenzoyl)phosphine oxide'], 'products': ['square shaped polymer']}]} | |
15 | ['a)', 'Toluene', 'NR', '60C/7d', 'O-Zr', 'R=H,Me,Ph', '(c', 'O-Zr', 'CuBr/DMF', 'RT/19h'] | {'Diels–Alder cycloaddition': [{'substrate': ['Toluene'], 'products': ['NR']}], 'Cu-catalysed azide-alkyne cycloaddition': [{'substrate': ['O-Zr', 'CuBr/DMF'], 'products': ['R=H,Me,Ph']}]} | |
16 | ['(q', 'a)', 'Zr', 'Zr', 'Zr', 'Zr', '9', 'cm"\'K)', '3.5', 'E=0.32eV', 'SOH', '2.8', 'In(T/S', '0.02M', '2.1', 'SH', 'HSO4', 'HOS', '1.4', '2.8', '3.0', '3.2', '3.4', 'Zr', 'Zr', 'Zr', 'Zr', '1000T/K'] | {'HSO4': [{'substrate': ['SH'], 'products': ['HOS']}]} | |
17 | ['a', 'Open', 'Closed', 'Heating', 'Cooling', 'Coil', 'Globule', 'PNIPAM-modified MOF', 'Thermoresponsive', 'ZrO4(OHcluster', 'Guest molecule', 'polymer', 'q', 'NH', 'NH2-HBDC', 'PNIPAM-NHS', '+', 'DMF', 'CHCI3', 'ZrCI4', '120C,24 h', '60C,48 h', 'UiO-66-NH2', 'UiO-66-PNIPAM'] | {'NH2-HBDC': [{'substrate': ['ZrO4(OHcluster'], 'products': ['UiO-66-NH2']}], 'PNIPAM-NHS': [{'substrate': ['UiO-66-NH2'], 'products': ['UiO-66-PNIPAM']}]} | |
18 | ['a', 'Nano-MOF', 'UiO-66-N.', '+', 'DBCO-DNA', 'MOF-DNA-Conjugate', '(q', 'ONA'] | {'SPAAC': [{'substrate': ['UiO-66-N3', 'DBCO-DNA'], 'products': ['MOF-DNA-Conjugate']}]} | |
19 | ['0.2 mol% cat', '1 atm CO2', 'nBu4NBr', '60h/25C', '~62%'] | {'FJI-H6(Cu)': [{'substrate': ['CO2', 'chloropropylene oxide'], 'products': ['cyclic carbonate']}]} | |
20 | ['a', 'NH2-bdc', 'HO/5days/85C', 'NH2', '76% exchange', 'Zr', 'T', 'TiCl4(THF)2', 'DMF /5days/85C', '38% exchange'] | {'NH2-bdc': [{'substrate': ['Br-bdc'], 'products': ['NH2-bdc']}], 'TiCl4(THF)2': [{'substrate': ['Zr'], 'products': ['Ti']}]} | |
21 | ['Zr', 'a)', 'Zr', '10', 'co', 'Co', 'UiO-66-[FeFe](dcbdt)(CO)6', '3-', 'umol', '2', '2', 'T', '30', '60', '06', '120', '150', 'Time/minutes', 'Background', '[FeFe](dcbdt)(CO)e', 'UiO-66', 'UiO-66-[FeFe](dcbdt)(CO)e'] | {'UiO-66-[FeFe](dcbdt)(CO)6': [{'substrate': ['CO'], 'products': ['H2']}]} | |
22 | ['DES (R2)4NX / HBD', 'R,COOH', 'R,COOR2', '2 h, 140C', 'R = alkyl, aryl', '42%-81%'] | {'DES (R2)4NX / HBD': [{'substrate': ['R,COOH', 'R = alkyl, aryl'], 'products': ['R,COOR2']}]} | |
23 | ['OH', 'OH', 'OH', 'Candida antarctica lipase', 'HO', 'OH', 'HO', 'OH'] | {'Candida antarctica lipase': [{'substrate': ['vinyl decanoate', 'choline:urea', 'choline:glucose'], 'products': ['glucose monodecanoate']}]} | |
24 | ['Et', 'OH', 'DES', 'N-Et', 'OH', 'Ultrasound', '0', 'anthracen-9-ylmethanol', '1-ethyl-1H-pyrrole-2,5-dione'] | {'DES': [{'substrate': ['N-ethylmaleimide', 'anthracen-9-ylmethanol'], 'products': ['1-ethyl-1H-pyrrole-2,5-dione', 'EtOH']}]} | |
25 | ['Ar', 'DES', 'R2OC', 'NH', 'H2N', 'NH2', 'R', 'X=O,s'] | {'Biginelli reaction': [{'substrate': ['aldehyde', 'ß-ketoester', 'urea'], 'products': ['3,4-dihydropyrimidin-2(1H)-one', 'thiones derivatives']}]} | |
26 | ['H', 'Choline chloride-based', 'COOH', 'CHO', 'DES', 'R-NC', 'R', '0'] | {'Passerini reaction': [{'substrate': ['benzaldehyde', 'benzoic acid', 'cyclohexyl isocyanide'], 'products': ['α-acyloxycarboxamide']}]} | |
27 | ['MT', 'OPP', 'OPP', 'SAM', 'MIBS', 'H', 'GPP', '2-Me-GPP', 'OPP', 'SodC', 'SAM', 'SodD', 'OPP', 'FPP', 'Lon22,DMAPP', 'OPP', 'R', 'IPP (R=H)', 'Lon23,SAM', 'dmGGPP', '(Z)-4-Me-IPP (R=Me)', 'OPP', 'SBS', '(2Z,6Z)-FPP', '5', '6'] | {'MIBS': [{'substrate': ['GPP', '2-Me-GPP'], 'products': ['1']}], 'SodC': [{'substrate': ['FPP'], 'products': ['2']}], 'SodD': [{'substrate': ['2'], 'products': ['3']}], 'Lon22': [{'substrate': ['DMAPP'], 'products': ['dmGGPP']}], 'Lon23': [{'substrate': ['IPP'], 'products': ['(Z)-4-Me-IPP']}], 'SBS': [{'substrate': ['... | |
28 | ['1,2-H~', 'OPP', 'FPP', 'B2', 'HcS', 'a)1,6-cy', '1.6-H', '1,11-cy', '2-H', '(R)-NPP', 'D2', 'C2', 'b) 1,11-cy', '1,6-cy', "1,3-H'~", 'A1', 'B1', 'B)', 'BbS', '1,6-cy', 'OPP', 'FPP', '(R)-NPP', '(S)-A3', 'SmTS6', '1,10-cy', 'OPP', 'FPP', 'A4'] | {'HcS': [{'substrate': ['1,2-H~', 'OPP', 'FPP'], 'products': ['B2', '(1,6-H)', '(1,11-cy)']}], 'BbS': [{'substrate': ['(R)-NPP', 'D2', 'C2'], 'products': ['B1', '(1,6-cy)', '(1,3-H~)']}], 'SmTS6': [{'substrate': ['OPP', 'FPP'], 'products': ['A4', '(1,10-cy)']}]} | |
29 | ['OPP', 'PP', '10', '10', '11 (R = CH2)', '11', '12 (R = O)', 'OPP', '13', 'B)', 'n-BuLi', 'OTBDPS', '14', '15', 'PIFA', 'OTBDPS', 'OTBDPS', '16', '17', 'TBAF', 'OH', 'PBr3', '13', '(NBu4)3HP2O7', '18'] | {'BbS': [{'substrate': ['PP analogue 10'], 'products': ['acyclic products']}, {'substrate': ['PP analogue 11'], 'products': ['1,6-cyclisation']}, {'substrate': ['PP analogue 12'], 'products': ['1,6-cyclisation']}, {'substrate': ['PP analogue 13'], 'products': ['new reaction paths']}], 'SmTS6': [{'substrate': ['PP analo... | |
30 | ['Compound 3', 'Compound 5', 'Compound 6', '0000', '0000', '0000', 'Oh', '1h', 'Y', '5h', 'Y', 'O.N.', 'Y', 'Oh', 'Y', '1h', 'Y', '5h', 'Y', 'O.N.', 'Oh', '1h', '5h', 'O.N.', 'Compound 7', 'Compound 8', 'Compound 9', '0000', '0000', '0000', 'Oh', '1h', '5h', 'O.N.', 'Oh', '1h', '5h', 'O.N.', 'Oh', '1h', '5h', 'O.N.', '... | {'Hydroxylation': [{'substrate': ['Compound 3', 'Compound 5', 'Compound 6', 'Compound 7', 'Compound 8', 'Compound 9', 'Compound 10', 'Compound 11', 'Compound 12', 'Compound 13'], 'products': ['OH', '2OH']}]} | |
31 | ['(b)', '(a)', 'CHzOH (C)', '3-0 bile acid', 'Bile acid', 'HCO3->CH2O2->CH2O', 'PAH', 'CH3OH', 'NAD(H)', 'HSD', 'FDH', 'FaldDH', 'ADH', 'W', '0', 'NADH', 'CO2', 'W', 'Enzymes', 'NAD', 'NADH NAD', 'NADH NAD', 'NADH NAD', 'NAD(H)', 'GDH', 'DCPIP(blue', 'Reduced DCPIP', '(colorless)', 'a-ketoglutaric acid', 'Glutamic acid... | {'3α-hydroxysteroid dehydrogenase (HSD)': [{'substrate': ['Bile acid'], 'products': ['3-0 bile acid']}], 'Diaphorase (DP)': [{'substrate': ['HCO3->CH2O2->CH2O'], 'products': ['CHzOH (C)']}], 'FaldDH': [{'substrate': ['NADH NAD'], 'products': ['NADH NAD']}], 'ADH': [{'substrate': ['NADH NAD'], 'products': ['NADH NAD']}]... | |
32 | ['Inner Channel', '(a)', '(b)', 'PVP', 'CoAc):PVP', '2000', 'BP-Co,O-NTs', 'Outer Channel', '0.27:1', 'CoAc', 'AP-CoO-NTs', '(mAh', '600', 'PVP', 'Co(Ac) : PVP', 'AP-CoO-NTs', 'Calcining', '0.54 :1', '1200', 'CP-Co,O-NTs', 'BP-Co,O,-NTs', '800', '0.3 A g-1', 'High', 'Voltage', 'Co(Ac) : PVP', '0.67:1', '00', 'Nu', '0',... | {'PHBH': [{'substrate': ['NADPH', 'FAD', 'COC', 'R', 'HO'], 'products': ['FADHOOH', 'H2O', 'COO', 'NF', 'COO', 'OH', 'COO', 'HO', 'OH', 'V', 'HO', 'HO', 'OH']}]} | |
33 | ['(b)', '(a)', '(c)', 'SAN', 'Burnt out SAN:pores & hollowness', 'Thermal', 'processes', 'PAN', 'Carbonized PAN', '1n', '100nm', '(d)', '250', '600', 'H2/N2', 'H2/N2', 'HCI', '(f', 'Ni(Ac)2', 'Oil=', 'PAN/PVP Composite', 'Ni', 'Amorphous Carbon', 'O Hollow Graphitic Carbon Nanosphere', '100nm', '00nm', 'O Ni Encapsulat... | {'Thermal Processes': [{'substrate': ['SAN', 'PAN'], 'products': ['Burnt out SAN:pores & hollowness', 'Carbonized PAN']}], 'H2/N2': [{'substrate': ['PAN/PVP Composite'], 'products': ['Amorphous Carbon']}], 'HCI': [{'substrate': ['Ni', 'Amorphous Carbon'], 'products': ['O Hollow Graphitic Carbon Nanosphere']}], 'Ni(Ac)2... | |
34 | ['lithiation', 'lithiation', 'delithiation', 'many cycles', '(a)', '(c)', '200nm', 'GeOx@C core-shell fiber', 'd)', 'GeOx', 'Li4.4Ge', 'Li2O', 'Carbon shell', 'SEI', '(b)', '1400', 'GeOx@C', '1200', '--charge', 'Specific capacity (mAh', '1000', '80mA/g', '--discharge', '320mA/g', '800', '800mAg', '600', '1600mA/g', '40... | {'Lithiation': [{'substrate': ['Li4.4Ge', 'Li2O'], 'products': ['GeOx']}], 'Delithiation': [{'substrate': ['GeOx'], 'products': ['Li4.4Ge', 'Li2O']}]} | |
35 | ['(b) 7', '(a)', 'Specific activity, [U mg-"]', '3.0', '-MES', 'Specific activity, [U mg"]', 'TRIS', '6', '2.5', 'HEPES', 'Carbonate', '2.0', '1.5', '1.0', '2', '0.5', '0.0', '5', '6', '7', '8', '9', '10', '11', '20 30 40 50 60 70 80', 'pH-value, []', "Temperature, ['C]"] | {'TR/Trx1': [{'substrate': ['DTT', 'NADP+'], 'products': ['TR', 'Trx1']}]} | |
36 | ['(a)', '30', 'Yield [%]', 'Selectivity [%]', ' 100', '120', 'c(1-PEA) [mM]', '25', '80', ' 100', 'c(1-PEA) [mM]', '20', '-80', '60', '15', '-60', '40', '10', '40', '20', '5.', '-20', '0', '0', '3', '8', '24', 'Time [h]', '(b)', '12', 'Yield [%]', 'Selectivity [%]', '100', '- 120', 'c(ECL)[mM]', '10', '80', ' 100', 'c(... | {'TR/Trx1': [{'substrate': ['ACP', 'DTT', 'CHO'], 'products': ['1-PEA', 'ECL']}], 'ADH': [{'substrate': ['ACP'], 'products': ['1-PEA']}], 'CHMO': [{'substrate': ['CHO'], 'products': ['ECL']}]} | |
37 | ['cathode', 'MV2+', 'MV+', 'E. coli', 'periplasm', 'MV2+', 'MV+', 'MtrA', 'STC', 'CymA', 'i2e"', '2e', 'cytoplasm', 'NADP++H+', 'NADPH', 'LbADH', 'HO', 'acetophenone', '(R)-1-phenylethanol'] | {'LbADH': [{'substrate': ['acetophenone'], 'products': ['(R)-1-phenylethanol']}], 'MtrA': [{'substrate': ['MV2+'], 'products': ['MV+']}], 'STC': [{'substrate': ['MV2+'], 'products': ['MV+']}], 'CymA': [{'substrate': ['MV2+'], 'products': ['MV+']}]} | |
38 | ['HO', '17', '12', '18', 'furanoflavonols', '19', 'furanoisoflavones', 'OH', '.', 'OH', 'm', '11', 'furanochalcones', '8', 'OEt', 'OH', '10', 'OH', 'R', 'furanocoumarins', 'OH', '2', '3', 'OH', '6', 'OF', 'H2N', '16', '15', '14', 'furanoisoquinolinones', 'furanoflavones'] | {'KOH': [{'substrate': ['ethyl 2-chloroacetoacetate', 'H2O/MeOH (6:1)'], 'products': ['≈65\u2009%']}, {'substrate': ['H2O/MeOH (1:2.5)'], 'products': ['>90\u2009%']}], 'Cu': [{'substrate': ['pyridine', 'DEG'], 'products': ['≈85\u2009%']}], 'NaH': [{'substrate': ['ethyl formate', 'PhMe'], 'products': ['10\u2005h']}, {'s... | |
39 | ['GOase', 'KRED119', '1a', 'OH', 'HO', '1c', '30C,3h', '30C,24 h', 'M-1b 50%', '(P)-1b 67%', '99% ', '89% '] | {'GOase': [{'substrate': ['1a', 'OH'], 'products': ['HO', '1c']}], 'KRED119': [{'substrate': ['1c'], 'products': ['M-1b', '(P)-1b']}]} | |
40 | ['Me', 'OMe', 'OMe', 'Kfast', 'Kelow', 'M-5b', 'B', 'GOase M35', 'GOase M35', 'OMe', 'C', 'Kslow', '5a', 'B', 'Atast', '5c', 'HO', 'P)-5b'] | {'GOase M35': [{'substrate': ['M-5b', 'B'], 'products': ['5a', 'B']}, {'substrate': ['5a', 'B'], 'products': ['5c', 'HO']}], 'Kfast': [{'substrate': ['5c', 'HO'], 'products': ['P)-5b']}], 'Kslow': [{'substrate': ['P)-5b'], 'products': ['Me', 'OMe']}]} | |
41 | ['100', '90', '-ee of 5b', '80', '70', '5a', '60', '% 50', '5b', '40', '-5c', '30', '20', '10', '0', '0', '50', '100', '150', '200', '250', '300', '350', '400', 'time/min'] | {'GOase M3-5': [{'substrate': ['5a'], 'products': ['5b', '5c']}]} | |
42 | ['Ru-BINAP', 'OH', 'H2', 'n=1:4', 'n =2: 5', 'OH', '2. NaCIO2', 'n=1:6', 'methyl-2-butene', 'n = 2: 7', 'R-OH', 'EDC', 'n = 1: 8a', 'n = 2: 9a', 'n =1: 8', 'n = 2: 9', 'I:R=', 'f: R', 'i:R =', 'n:R', 'j: R ='] | {'Ru-BINAP': [{'substrate': ['OH', 'H2'], 'products': ['n=1:4', 'n=2:5']}], 'NaCIO2': [{'substrate': ['OH'], 'products': ['n=1:6']}], 'EDC': [{'substrate': ['methyl-2-butene', 'n=2:7', 'R-OH'], 'products': ['n=1:8a', 'n=2:9a']}, {'substrate': ['n=1:8', 'n=2:9', 'I:R=', 'f:R', 'i:R=', 'n:R', 'j:R='], 'products': ['n=1:8... | |
43 | ['hydrolysis', 'elimination', 'hydrogenation', 'phosphatase', 'oxidation', 'GPP', 'FPP', '8a', 'GGPP', '53', '9a', 'GFPP', '58', '14a', 'FFPP', '3', '30', '15a', '28', 'GGFPP', 'OH', '63'] | {'Hydrolysis': [{'substrate': ['GPP', 'FPP', 'GGPP', 'GFPP', 'FFPP', 'GGFPP'], 'products': ['53', '9a', '58', '14a', '3', '30', '15a', '28', 'OH', '63']}], 'Elimination': [{'substrate': ['GPP', 'FPP', 'GGPP', 'GFPP', 'FFPP', 'GGFPP'], 'products': ['α- and β-terpene hydrocarbons']}], 'Hydrogenation': [{'substrate': ['4'... | |
44 | ['HRP', 'A', 'IH', 'Hi', 'ECM', 'HN', 'NH', 'N', 'HRP', 'Streptavidin', 'Biotin', 'HRP Horseradish', 'Peroxidase', 'B', '250', '***', '*', '200', 'Rel. Absorbance [%]', '150', '100', '50', '8888', '0', 'CoECM', 'BeocECM', 'PeocECM', 'HeocECM', 'CpECM'] | {'HRP': [{'substrate': ['Biotin'], 'products': ['TMB']}], 'Streptavidin': [{'substrate': ['HRP'], 'products': ['HRP-linked streptavidin']}]} | |
45 | ['B', 'A', 'Microscale', 'reaction mixture in DMSO', 'Bound', 'Coupling', 'FR1-FR2', 'reagents', 'FR1', 'FR1', 'FR2', 'Enzyme', 'preincubation', 'Enzyme', 'FR2', 'ENZYME', 'NO EFFECT', 'INHIBITION', '100', '100', '% of Inhibition', '% of Inhibition', 'FR1-FR2', '-', 'I Activity', 'FR1 FR2', 'FR1', 'FR2', 'i bound', '-'... | {'FXIIa': [{'substrate': ['FR1', 'FR2'], 'products': ['FR1-FR2']}], 'Thrombin': [{'substrate': ['FR1', 'FR2'], 'products': ['FR1-FR2']}]} | |
46 | ['EDCI,DMAP', 'DMSO-d6', '8', '13a', 'A', 'Microscale reaction mixture(H NMR', 'DMAP', 'EDCI/EDU', 'DMAP', 'EDU', 'Water', '9.0', '8.5', '8.0', '7.5', '7.0', '6.5', '6.0', '5.5', '5.0', '4.5', '4.0', '3.5', '3.0', '2.5', '2.0', '1.5', '1.0', '0.5', '0.0', '-', 'ppm', 'B', '-', '13a', '13a', '13a', '1.00 1.81', '1.96', ... | {'EDCI/DMAP': [{'substrate': ['Aminotriazole 7'], 'products': ['13a']}]} | |
47 | ['Ar-I (3 equiv.), AgOAc (2 equiv.)', 'AQ', 'Pd(OAc)2 (5 mol-%), no solvent', '110C,24 h', '0.50 mmol', '.', '2', 'OMe', 'C', '2a', '2b', '2c', '2d', '78%(rac)', '83%', '78%', '81%', '86% (88% ee)'] | {'Pd(OAc)2': [{'substrate': ['Ar-I', 'AgOAc'], 'products': ['2a', '2b', '2c', '2d']}]} | |
48 | ['Ar-I3 equiv.),AgCO1 equiv.)', 'AQ', 'PivOH (0.3 equiv.),Pd(OAc)2(10 mol-%)', 'Boc', 'toluene (0.3 M,110C,72 h', 'Boc', '5', 'scale:0.50 mmol', '6', 'OMe', 'CI', 'CI', 'Boc', 'Boc', 'Boc', 'O', 'Boc', 'O', '6a', '6b', '6c', '6d', '53% (>98% ee)', '59%', '41%', '38%', 'ent-6a 52%'] | {'AgCO1': [{'substrate': ['Ar-I3', 'PivOH'], 'products': ['6a', '6b', '6c', '6d']}], 'Pd(OAc)2': [{'substrate': ['Boc-5', 'toluene'], 'products': ['6a', '6b', '6c', '6d']}]} | |
49 | ['Ar-I (3 equiv.),AgCO1 equiv.)', 'AQF', 'PivOH (30 mol-%), Pd(OAc)2 (5 mol-%)', 'AQ', 'N', 'no solvent,110 C,24 h', 'Boc', 'N', 'Boc', '9', '10', 'OMe', 'AQ', 'AQ', 'AQ', 'AQ', 'Boc', 'Boc', 'N', 'Boc', 'Boc', '10a', '10b', '10c', '10d', '78%', '82% (83% 2.8 mmol)[a]', '89%', '52%', 'CN', 'cOMe', 'OEt', 'AQ', 'AQ', 'A... | {'Ar-I': [{'substrate': ['N-Boc-piperidinecarboxamide 9'], 'products': ['10a', '10b', '10c', '10d', '10e', '10f', '10g', '10h']}], 'AgCO3': [{'substrate': ['N-Boc-piperidinecarboxamide 9'], 'products': ['10a', '10b', '10c', '10d', '10e', '10f', '10g', '10h']}], 'PivOH': [{'substrate': ['N-Boc-piperidinecarboxamide 9'],... | |
50 | ['SMe', '14a', '15a', '16a', 'combined yield:', '78%', '68%', '<5%', 'dr:', '83:17', '80:20', 'oreferred conditions:', 'AgCO3,PivOH', 'Ag2CO3,PivOH', 'Pd(OAc)2', 'Pd(OAc)2', 'tert-amyl-OH (0.2 M)', 'tert-amyl-OH (0.5 M)'] | {'AgCO3': [{'substrate': ['SMe', '14a', '15a', '16a'], 'products': ['14a', '15a', '16a']}], 'Ag2CO3': [{'substrate': ['SMe', '14a', '15a', '16a'], 'products': ['14a', '15a', '16a']}], 'Pd(OAc)2': [{'substrate': ['SMe', '14a', '15a', '16a'], 'products': ['14a', '15a', '16a']}], 'tert-amyl-OH': [{'substrate': ['SMe', '14... | |
51 | ['I3 equiv.),Ag2CO31 equiv.)', 'Ar', 'Pd(OAc)2 (5 mol-%),', 'AQ', 'tert-amyl-OH (0.2 M)', '.', '110C,24h', '13', '14', 'scale: 0.50 mmol', 'OMe', 'CI', 'AQ', 'AQ', 'AQ', 'AQ', '14a', '14b', '14c', '14d', '90%', '92%', '78%', '67%', 'dr 80:20', 'dr 83:17', 'dr 82:18', 'dr.72:28'] | {'Pd(OAc)2': [{'substrate': ['I3', 'Ar', 'tert-amyl-OH'], 'products': ['13', '14']}], 'Ag2CO3': [{'substrate': ['OMe', 'CI'], 'products': ['14a', '14b', '14c', '14d']}]} | |
52 | ['a)', 'pTolSCI', '22(0.9 equiv', '230.8 equiv)', 'pTolSCI', '(1 equiv)', 'TTBP1 equiv', 'TTBP (1 equiv)', '0.9 equiv)', '71% yield', '211 equiv', 'A', 'Y', 'Y', 'A', 'for the three', 'AgOTf (4 equiv', '5 min120min', '15 min5 min120 min', 'step one', '-78', '-10', '-78', '-10', 'pot reactions', 'b)', 'pTolSCI', '170.9 ... | {'pTolSCI': [{'substrate': ['TTBP', 'TTBP'], 'products': ['OLev', 'OBn']}, {'substrate': ['TTBP'], 'products': ['OLev', 'OBn']}], 'AgOTf': [{'substrate': ['OLev', 'OBn'], 'products': ['TBSO', 'N3']}, {'substrate': ['OLev'], 'products': ['BnO', 'Nal']}], 'OEt': [{'substrate': ['BzO'], 'products': ['OBn', 'STol']}], 'OH'... | |
53 | ['OH', 'OH', 'L-threonine', 'CO2H', 'aldolase', 'NH2', 'KPi pH 8.0', '2S)-syn-3', '(2S)-anti-3', '200 M PLP', 'OH', 'R1', 'NH2', 'D-threonine', '1', '2', 'aldolase', 'OH', 'HO', 'COH', 'CO2H', 'KPi pH 8.0', 'R', 'NH2', "'NH2", '200M PLP', 'R2', 'R2', '(2R)-syn-3', '(2R)-anti-3'] | {'L-threonine aldolase from Aeromonas jandaei': [{'substrate': ['L-threonine', 'R1'], 'products': ['OH', '(2S)-syn-3', '(2S)-anti-3']}], 'D-threonine aldolase from Pseudomonas sp.': [{'substrate': ['D-threonine', 'R2'], 'products': ['OH', '(2R)-syn-3', '(2R)-anti-3']}]} | |
54 | ['OF', 'C', 'HO', 'OH', 'Glc-1P', 'deoxy-fluoro-D-glucoses 2F-Glc,3F-Glc or 6F-Glc)', 'HEPES', 'CBP', 'pH 7.2', '37', 'B', 'OH', 'OH', 'HO', 'CDP', 'HC', 'HPO42', 'HO', 'HO', 'OH', 'HEPES', 'HO', 'OF', '2F-cellobiose (1)', 'pH 7.2', 'Glc-1P', '37', '2F-EpC (4)', '3F-cellobiose (2)', '3F-EpC (5)', '6F-cellobiose (3)', '... | {'Cellobiose Phosphorylase (CBP)': [{'substrate': ['Glc-1P', '2F-Glc', '3F-Glc', '6F-Glc'], 'products': ['2F-cellobiose (1)', '3F-cellobiose (2)', '6F-cellobiose (3)']}], 'Cellodextrin Phosphorylase (CDP)': [{'substrate': ['2F-cellobiose (1)', '3F-cellobiose (2)', '6F-cellobiose (3)'], 'products': ['2F-EpC (4)', '3F-Ep... | |
55 | ['b)', 'a)', '.', 'Cu/SmO@AIO1.5', '65', '4.0', ' Cu/YO@AIOz(1.5)', 'CO/CO molar ratio in products (-)', ' Cu/ScO@AIO1.5', '60', '3.5', 'Cu/ZrO@AIO1.5', 'selectivity (%)', 'Cu/AIO1.5', '55', '3.0', 'Cu/TaO@AIO1.5', 'Cu/TaO@AIO3.0', '50', '2.5', 'V Cu/TaO@AIO(4.5)', '45', 'Methanol', '2.0', '40', '1.5', '35', '1.0', '30... | {'Cu/MOx@Al2O3': [{'substrate': ['propylene carbonate'], 'products': ['methanol', 'CO', 'CO2']}]} | |
56 | ['Mg(NO)2-6HO', '2,5-dioxidoterephthalate(DOT)', 'solvent exchange', 'activation', 'Mg-MOF-74-DMF', 'Mg-MOF-74'] | {'Mg(NO3)2-6H2O': [{'substrate': ['2,5-dihydroxyterephthalate(DOT)'], 'products': ['Mg-MOF-74']}]} | |
57 | ['SpAS1 H103X', 'A)', 'B)', '5', 'C', '4', 'H', 'Iog[K./K (s" M\')] sulfate 4', 'log[Kk/K (s M)] sulfate 4', "log[K/K (s M')] sulfate 4", '3', '0.', '3', 'M', 'S', '3', 'Q', 'HO', '2', '2', '2', 'DO', 'E', '1', 'N', 'N', '1', 'W', 'KO', 'ne', '1', '2', '-2', '2', '-2', '-1', '0', '1', '2', '3', '5', '-2', '-1', '0', '1... | {'SpAS1 H103X': [{'substrate': ['sulfate 4'], 'products': ['phosphate 1', 'phosphate 2b', 'phosphonate 3a']}], 'RlPMH T107X': [{'substrate': ['phosphate 1', 'phosphate 2b'], 'products': ['sulfate 4']}]} | |
58 | ['2.510', '2.0x10-3', '1.510-3', 'obs', '1.010-3', '5.01', '0.0-', '0.00', '0.01', '0.02', '0.03', '0.04', '[nCuO]/mg/mL'] | {'RhCl3*3 H2O': [{'substrate': ['1.)EtO(CH)OH/HO(3:1)', '2.)AgPF6.CH3CN', 'tBu', 'tBu', 'Me', 'Me', 'Bu', 'rac-Rhind', 'KCO3.EtOH,70C,6 h', 'h', '(S)-2', 'tBu', 'tBu', 'Bu', 'tB', '-(S)-3', '-(S)-4'], 'products': ['-(S)-3', '-(S)-4', 'A-RhInd', '-RhInd']}]} | |
59 | ['3.210', '3.010-3', '2.810-3', ' 2.6x10-3', 'bs', '2.410', '2.210-3', '2.010-3', '1.810-3', '0', '10', '20', '30', '40', '50', '60', 'Delay time/min'] | {'CuO nanoparticles': [{'substrate': ['CblNO2', 'Asc'], 'products': ['CblNO']}]} | |
60 | ['a)', 'b)', '7.0104', '8.5104', '6.8104', '8.0104', '6.6104', ' 7.510-4', 'obs', 'sqo', '6.410', '7.0104', '6.2x10-4', '6.5104', '6.0104', '6.0104', '0', '10', '20', '30', '40', '50', '0', '10', '20', '30', '40', '50', 'Delay time / min', 'Delay time / min'] | {'Fe3O4': [{'substrate': ['CblNO2', 'Asc'], 'products': ['CblNO']}], 'Fe3O4 (with stabilizer)': [{'substrate': ['CblNO2', 'Asc'], 'products': ['CblNO']}], 'CuO': [{'substrate': ['CblNO2', 'Asc'], 'products': ['CblNO']}]} | |
61 | ['MWCNT-PDA/GO Mixture Solution', 'MWCNT-PDA/GO', 'Hybrid Aerogel', 'HydrothermalProcess', 'Freeze-drying Process', 'MWCNT-PDA/GO Hybrid Hydrogel', 'HOOC', 'Complexation', 'OH', 'COOH', 'HOOC', 'OH', ':CuII', '0', 'COOH', ':PbII', 'HO', 'Chelation', 'OOH', 'HOOC', 'NH2', 'COOH', 'Hal', 'OH', 'HO', 'OH', 'C=O', 'HOOC', ... | {'MWCNT-PDA/GO Mixture Solution': [], 'MWCNT-PDA/GO Hybrid Aerogel': [], 'Hydrothermal Process': [], 'Freeze-drying Process': [], 'MWCNT-PDA/GO Hybrid Hydrogel': [], 'Complexation': [{'substrate': ['Cu2+'], 'products': ['COOH']}, {'substrate': ['Pb2+'], 'products': ['HO']}], 'Chelation': [{'substrate': ['Cu2+', 'OH'], ... | |
62 | ['TsO', 'a', '18', '[18F]2'] | {'K[18F]F': [{'substrate': ['2-azidoethyl 4-methylbenzenesulfonate'], 'products': ['[18F]-1-azido-2-fluoroethane']}], 'CuSO4': [{'substrate': ['[18F]-1-azido-2-fluoroethane', 'alkyne precursor 18'], 'products': ['[18F]-2']}]} | |
63 | ['Starting material', 'Alkylating agent', 'Product', 'By-product', '(leaving group)', 'prenyl', 'O-P-O-P-OH', 'transferase', '0-P-O-P-OH', 'o', 'o', 'o', 'Prenyl diphosphate', 'Diphosphate', 'NH2', 'methyl', 'HOOC', 'transferase', 'NH2', 'NH', 'HO OH', 'HO OH', 'S-adenosyl-L-methionine', 'S-adenosyl-L-homocysteine', 'O... | {'Prenyltransferase': [{'substrate': ['Prenyl diphosphate', 'Diphosphate'], 'products': ['Starting material', 'Alkylating agent', '(leaving group)']}], 'Methyltransferase': [{'substrate': ['S-adenosyl-L-methionine', 'NH2'], 'products': ['S-adenosyl-L-homocysteine', 'NH', 'HOOC']}], 'Glycosyltransferase': [{'substrate':... | |
64 | ['a)Proposedmechanism for photoenzymatic radical hydroalkylation', 'Glucose', 'Gluconolactone', 'GDF', 'NADPH', 'NADP*', 'FMN', 'FMN', 'Product', 'Substrates', 'HN', 'FMNso', 'FMNno', 'iit', 'yan LED', 'FMNs', 'b)Intramolecular radical hydroalkylation(reductive cyclization)', 'd) Proposed mechanism for redox neutral ra... | {'ERED': [{'substrate': ['Glucose', 'Gluconolactone', 'GDF', 'NADPH', 'NADP*', 'FMN', 'X', 'Me', 'R', 'tricine', "tricine'", 'R4', 'R3', 'R2', 'R1LCI', 'R1R2', 'R1', 'N'], 'products': ['FMN', 'FMNso', 'FMNno', 'Product', 'FMNs', 'FMNsq', 'FMN', 'Me', 'R3', 'R2', 'R1', 'R4']}]} | |
65 | ['a Biocatalytic alkylation with sulfonium intermediates', 'c)Stereoselective methylation reactions', 'MT', 'NuH', 'Nu-R', 'COOH', 'Me', 'MT', 'Mel', 'COOH', 'HMT', 'R', 'NH', 'up to 98% e.e.', '+NH', 'HO OH', 'HO OH', 'NHR2', 'Me', 'SAM-analog', 'SAH', 'MT', 'R10', 'sulfonium intermediate', 'Mel', 'NR', 'HMT', 'H', 'H... | {'Halide Methyl Transferase (HMT)': [{'substrate': ['S-adenosyl-l-homocysteine (SAH)', 'Haloalkanes'], 'products': ['S-adenosyl-l-methionine (SAM) analogs', 'Halide']}], 'Methyltransferase (MT)': [{'substrate': ['S-adenosyl-l-methionine (SAM) analogs', 'Proteins', 'DNA', 'Small molecules'], 'products': ['S-adenosyl-l-h... | |
66 | ['a Chemical akylation of N-heterocyclic compounds', 'R', 'RX, X = CI, Br', 'NH', 'N-R', 'K2CO3,MeCN', 'Pyrazoles', '1-Alkylpyrazoles', '2-Alkylpyrazoles', 'R', 'RX, X=CI, Br, I, OTs', 'R', 'HN-N', 'N', '-N', 'N', 'N', 'N', 'NaOH', '1,2,3-Triazole', '1-Alkyltriazole', '2-Alkyltriazole', 'RX,X=CI, Br,I', 'Solvent', 'H',... | {'MTs': [{'substrate': ['Pyrazoles', 'CH3'], 'products': ['1-Methylpyrazoles', '2-Methylpyrazoles']}], 'CmoA': [{'substrate': ['Prephenate', 'SAM (R =H)or SAE (R=CH3)'], 'products': ['cxSAM(R=Hor cxSAE(R=CH)']}]} | |
67 | ['Chemoenzymatic synthesis of SAM analogues', 'NH3*', 'Na, NH3, -78C', 'OOC', 'OOC', 'COO', 'CHN', 'NH3', 'R-Br', 'Br', 'Homocystine', 'Methionine analogue', 'NH2', 'NH2', 'OOC', '0', '0', 'MAT', 'HO', 'NH3', 'OH', 'OH', 'OH', 'NH3', 'P; + PPi', 'Methionine analogue', 'OHOH', 'OHOH', 'ATP', 'SAM analogue', 'NH2', 'NH2'... | {'Methionine Adenosyltransferase (MAT)': [{'substrate': ['Methionine Analogue', 'ATP'], 'products': ['SAM Analogue', 'AMP']}], 'Halogenase': [{'substrate': ['Methionine Analogue', "5'-Chloro-5'-deoxyadenosine (X=CI)"], 'products': ['SAM Analogue']}, {'substrate': ['Methionine Analogue', "5'-Fluoro-5'-deoxyadenosine (X=... | |
68 | ['aHMT-MT cascade reactions', 'MT', 'Alkylated', 'Substrate', 'product', 'NH2', 'NH2', 'R', '000', 'NH3', 'NH3', 'HOHO', 'HOHO', 'SAM analogue', 'SAH', 'R-I', 'HMT', 'b)Methylated products', 'OH', 'NH', 'HO', 'OH', 'CH3', 'CH3', 'CH2', 'CH3', 'HO', 'OH', 'HO', "'OH", 'N-CH3', 'H3C', 'R', 'OH', 'N', 'OH', 'CH3', 'CH3', ... | {'Halide Methyltransferase (HMT)': [{'substrate': ['Methyl Iodide', 'SAH'], 'products': ['SAM', 'Iodide']}], 'Methyltransferase (MT)': [{'substrate': ['SAM'], 'products': ['Methylated Products']}], 'Alkyl-Promiscuous MTs': [{'substrate': ['SAH'], 'products': ['Alkylated Products']}]} | |
69 | ['3a', '77%', '88%', '4a', '8a', 'late', 'early', '80%', 'metalation', 'metalation', '80%', '15', '10a', 'a)', 'b', '13%', '67%', 'R=CgF', '17', 'NHFmoc', 'HO', '18', 'NHFmoc', 'H', 'OPfp'] | {'Mn(OAc)2\u2009×\u20094 H2O, NaOAc, EtOH, r.t.': [{'substrate': ['3a'], 'products': ['4a']}], 'NαFmoc-lysine, Hünig base, DMF/water, 2:1, 80\u2009%': [{'substrate': ['4a'], 'products': ['8a']}], 'PfpOH, EDC, CH2Cl2, EtOAc, yield 80\u2009%': [{'substrate': ['8a'], 'products': ['10a']}], 'Manganese acetate': [{'substrat... | |
70 | ['cycle', 'R', 'cycle', 'R', 'R2', 'R3', '4a-g', 'R3', '1a-s', 'R3', '3a-n'] | {'Montmorillonite K-10': [{'substrate': ['five- or six-membered cycle', 'benzaldehyde'], 'products': ['Bis-arylidene derivatives 1\u2009a–s']}], 'HCl(g)': [{'substrate': ['five- or six-membered cycle', 'benzaldehyde'], 'products': ['Bis-arylidene derivatives 1\u2009a–s']}], 'CH3CO2H': [{'substrate': ['five- or six-memb... | |
71 | ['R-H', 'R', "'PC-H", 'P('] | {'PC*': [{'substrate': ['R-H'], 'products': ['R', "'PC-H"]}, {'substrate': ["P('"], 'products': ['R-H']}]} | |
72 | ['N', 'C6H13', '16', 'PrOiOC', '17', '215W', 'household', 'COOH', 'bulbs,2 h', '0.1 equiv.)', 'OOP', 'HN', '18', 'COO/Pr', 'r.t.', 'NH2OH-HCI', '20 h', 'EtoN', 'OH', 'H', '19,95%', '20,89%'] | {'Phenylglyoxylic acid': [{'substrate': ['C6H13', '16'], 'products': ['18']}], 'Diisopropyl azodicarboxylate': [{'substrate': ['17'], 'products': ['18']}], 'Ethanolamine': [{'substrate': ['18'], 'products': ['19']}], 'Hydroxylamine hydrochloride': [{'substrate': ['18'], 'products': ['20']}]} | |
73 | ['C5H1', '33: 65%', 'cis/trans=65:35', 'COOEt', 'PTFE tubing', 'V=10mL', 'NaBH4', 'in EtOH', 'H', 'COOEt', 'COOEt', 'CgH13', 'COOEt', 'COOEt', "31'", '32', 'Et000', '[HW1oO32]4', '[W10O32]4', 'EtOOC', '125W', 'Hg lamp', '[W10O32', '30', 'C6H13', 'PTFE tubing', '16', 'V=12 mL', '0.1 mLmin-1'] | {'TBADT': [{'substrate': ['Heptanealdehyde (16)', 'Diethyl maleate'], 'products': ['Radical adduct 31·', 'Hydroacylated derivative 32']}], 'NaBH4': [{'substrate': ['Hydroacylated derivative 32'], 'products': ['γ-lactones (33)']}], 'Sunlight': [{'substrate': ['Dimethyl(phenyl)silane (43)', 'Phenyl vinyl sulfone (44)'], ... | |
74 | ['1a', '[Ru"] (5 mol-%)', '+', 'TBHP (4 equiv.)', 'MeCN,hv,40 h', 'Ph', 'Ph', 'Ar', '86:64%', '85', 'Ph', '34W', 'tBuOOH', 'hi', 'blue LED', '[Ru"]', 'HO+', 'tBuO', '[Rull', 'HA', '1a', 'tBuOH', 'Ph', "4'a", 'H', '.88', '85', '88', 'HO', 'HO', '86', 'uc', "87'", '[Ru]=Ru"(bpV)3Cl'] | {'RuII(bpy)3Cl2': [{'substrate': ['TBHP', 'THF', 'benzaldehydes', 'styrenes', 'alkynes', 'aldehydes'], 'products': ['tert-butoxyl radical', 'α-oxy radical', 'adduct', 'cation', 'deprotonation', '3-sulfonylated coumarins', 'vinylation', 'α,β-epoxy ketones', 'benzoyl radicals', 'acyl chlorides', 'benzamides']}], 'TBHP': ... | |
75 | ['Acridine red (2 mol-%', 'TBHP (4 equiv.),4 A MS', 'Acetone,r.t.,12 h', '3 W green LED', '100a: 67%(R =H)', '98', 'b:55%(R=Me)', '99a-c', 'c: 70% (R = CI)'] | {'Acridine red': [{'substrate': ['TBHP', '1,4-dioxane'], 'products': ['99a-c', '100a-c']}], 'TBHP': [{'substrate': ['1,4-dioxane'], 'products': ['99a-c', '100a-c']}], 'MS': [{'substrate': ['1,4-dioxane'], 'products': ['99a-c', '100a-c']}], 'Acetone': [{'substrate': ['1,4-dioxane'], 'products': ['99a-c', '100a-c']}], 'L... | |
76 | ['OH', 'HO', '5', '2a', '6a-46a', 'R', 'HO', 'HO', 'OH', '2b', '6b-46b', 'R'] | {'Friedel–Crafts acylation': [{'substrate': ['2-bromothiophene', 'glutaric anhydride'], 'products': ['precursor 5']}], 'Suzuki reaction': [{'substrate': ['precursor 5'], 'products': ['2a']}], 'Coupling': [{'substrate': ['2a'], 'products': ['6a-46a']}]} | |
77 | ['H', 'GalOx', 'OH', 'OH', 'HMF', 'FDCA', 'DFF', '02', 'H2O2', 'CalB', 'HOO', 'OH', 'OH'] | {'GalOx': [{'substrate': ['HMF'], 'products': ['DFF', 'H2O2']}], 'CalB': [{'substrate': ['H2O2', 'Ethyl Acetate'], 'products': ['Peracetic Acid']}], 'Peracetic Acid': [{'substrate': ['DFF'], 'products': ['FDCA']}]} | |
78 | ['HzO2', 'HMF', 'Ethyl acetate', 'one phase', 'FDCAL', 'Buffer', 'GalOx + HRP + catalase', 'CalB (peracid-mediated)', 'HO', 'HO', 'OH', 'DFF', 'DFF', 'FDCA', 'HMF'] | {'GalOx + HRP + catalase': [{'substrate': ['HMF'], 'products': ['HO', 'OH']}], 'CalB (peracid-mediated)': [{'substrate': ['DFF'], 'products': ['FDCA']}]} | |
79 | ['Ar', 'Ar_air, KIO30 mol%)', '24 examples', 'HC', 'ethyl lactate,90', '75-85% yield', 'R1=Ar,AIkyl;Ar=4-MePh2-MePh,4-CIPh4-BrPh', 'R2=R3=H.Me,Et,Pr', 'R2=Me,H;R3=4-MePh,3-CIPh', 'Atom economy ', 'E-factor', 'Safety', 'Solvent '] | {'KIO3': [{'substrate': ['enaminones', 'thiophenols'], 'products': ['aminothioalkenes']}]} | |
80 | ['2 mol% AuCl', 'OH', 'MeNO2,65-100C', 'R', 'R1', '-R3 + R4SH', 'R3', 'R2', '2 mol%Pd(OAc)2', '2 mol% AuCI', 'MeNO2,80 C', 'a', 'AlK', 'AI', 'H SAr2', 'H SAr2', 'H SAr', '16 examples', '7 examples', '6examples', '60-97% yield', '62-97% yield', '47-71% yield', '(b)', 'SAr', 'SPh', 'SAIK', 'SAr/AIk', '10 examples', '99%y... | {'AuCl': [{'substrate': ['R', 'R1'], 'products': ['R3', 'R4SH']}], 'Pd(OAc)2': [{'substrate': ['R3'], 'products': ['R2']}, {'substrate': ['R2S'], 'products': ['PhS']}]} | |
81 | ['A', 'iso', 'TE', 'Acyl-', 'CoA DH', 'DS', 'Amt', 'ER', 'FAAL', 'ACP', 'DH', 'AT', 'ACF', 'B', 'Iso2', 'Iso5', 'Iso6', 'Iso9', 'Module 1', 'Module 2', 'Module 3', 'Iso7', 'Module 4', 'Acyl-', 'CoA DH', '*', 'Amt', 'ER', 'FAAL', 'ACP', 'KS', 'AT', 'ACP', 'ACP', 'ACP', 'ACP', 'DH', 'KR', 'ACF', 'TE', 'HO', 'Am', 'Iso4',... | {'Iso2': [{'substrate': ['3-oxodecanoic acid', '9-methyl-3-oxodecanoic acid'], 'products': ['acid-adenosine monophosphate (AMP)']}], 'Iso5': [{'substrate': ['decanoic acid', 'malonyl-coenzyme A (CoA)'], 'products': ['acyl chain']}], 'Iso6': [{'substrate': ['acyl chain'], 'products': ['amino group']}], 'Iso4': [{'substr... | |
82 | ['{RhcodCI}],NHCI', 'NH', 'tBujosiphos,H2', 'NH.OAc', '98% yield', '95% ee', '92% yield', '>99.95% ee', '(R)-transaminase', 'FC', 'NH2'] | {'Rhodium-catalyst': [{'substrate': ['NHCI', 'tBujosiphos', 'H2'], 'products': ['NH', 'OAc']}], '(R)-transaminase': [{'substrate': ['FC'], 'products': ['NH2']}]} | |
83 | ['Alternating Current Electrolysis', 'R1-S-S-R1', 'oxidation', '10 mA', 'R1-S-S-R2', 'R2-S-S-R2', 'R1-S-S-R3', 'current', 'R3-S-S-R3', '-10 mA', 'R2-S-S-R3', 'reduction', 'etc.', 'time', 'etc.'] | {'Alternating Current Electrolysis': [{'substrate': ['R1-S-S-R1', 'R2-S-S-R2', 'R3-S-S-R3'], 'products': ['R1-S-S-R2', 'R1-S-S-R3', 'R2-S-S-R3']}]} | |
84 | ['Br+2OH', 'A', '2 H2O', 'N', '2e', 'OH', '1', 'H0', '2OH', '2e', 'OH', 'BrC', 'OH', '2Hads', 'glucose', 'CO2H', 'CH2OH', 'H', 'HO', 'H', 'OH', 'HO', 'H', 'HO', '-H', 'H', 'OH', 'H', 'HO', 'H', 'OH', 'H', 'OH', 'gluconic acid', 'CHOH', 'CHOH', 'sorbitol'] | {'Br+2OH': [{'substrate': ['glucose'], 'products': ['gluconic acid', 'sorbitol']}], 'A': [{'substrate': ['glucose'], 'products': ['gluconic acid', 'sorbitol']}], '2 H2O': [{'substrate': ['glucose'], 'products': ['gluconic acid', 'sorbitol']}], 'N': [{'substrate': ['glucose'], 'products': ['gluconic acid', 'sorbitol']}]... | |
85 | ['a)', 'pH 3.3', '80', 'pH 4.3', 'pH5.2', 'pH 6.1', '60', 'pH 7.1', 'FI Intensity / a.u', 'pH 8.2', '365nm UV Light', '40', '20', '0', '500', '520', '540', '560', '580', '600', '620', '640', 'b)', 'Wavelength/nm', '7.5', '5U of BL in 10mg of PenG/10mL', '7.0', '5U of BL in 25mg of PenG/10mL', '5U of BL in 50mg of PenG/... | {'β-lactamase': [{'substrate': ['penicillin G'], 'products': ['penicilloic acid']}]} | |
86 | ['b)', 'a', '100%', '100%', 'fluorescenceintensity', 'Relative fluorescence intensity', 'FMSNP/PenG', '80%', 'Std BL 0.5U', '80%', 'Std BL0.025U', 'Std BL 6.2510U', '60%', '-Std BL3.1310U', 'Std BL 1.5610U', '60%', 'Std BL 7.8210U', '40%', 'Relative', '40%', 'FMSNP/PenG', 'Wild type-AB(S', '7398-AB(S', '20%', '20%', '7... | {'β-lactamase': [{'substrate': ['FSNP/PenG'], 'products': ['fluorescence']}]} | |
87 | ['rtho Substitution', 'OH', '1 BnBr', '3', '2) PhB(OH)2, Pd(PPh)4', 'Piperidine', '1KCO3DMF/CHO,Reflux 1-3 h', 'EtOH,reflux,12 h', 'Br', '2NaCO3,Toluene:EtOH,80C', 'Ph', 'Ph', '79c', '80i', '81i', '81%', 'IC5o=16M', 'Para Substitution', '1R4BnBr', '3', '2) PhBOH)2,Pd(PPh3)4', 'Piperidine', 'HO', '1) KCO3,DMF/(CH3)O,Ref... | {'Pd(PPh)4': [{'substrate': ['PhB(OH)2', '1BnBr'], 'products': ['Ph', '79c']}, {'substrate': ['PhB(OH)2', '1R4BnBr'], 'products': ['Ph', '82c']}], 'Pd(PPh3)4': [{'substrate': ['PhB(OH)2', '1R4BnBr'], 'products': ['Ph', '83g-h']}], 'KCO3': [{'substrate': ['1BnBr'], 'products': ['80i']}, {'substrate': ['1R4BnBr'], 'produ... | |
88 | ['ve', 'NH2', 'cat.DMAP', 'CHCI', '8%', 'MeO', 'MeO', 'OMe', 'TR', 'NH'] | {'cat.DMAP': [{'substrate': ['bis-amine 3', 'methoxyisophthaloyl dichloride'], 'products': ['[2]catenane 4']}], 'TR': [{'substrate': ['bis-amine 3'], 'products': ['[2]catenane 4']}]} | |
89 | ['Ph', 'Ph', 'sophthaloyl dichloride', 'CHCI3/CH3CN (9:1', 'p-xylenediamine', 'NEt3', '97%', 'NH HN', 'Ph', 'Ph', 'NH HN'] | {'p-xylenediamine': [{'substrate': ['isophthaloyl dichloride'], 'products': ['fumaramide axle 8']}], 'NEt3': [{'substrate': ['fumaramide axle 8'], 'products': ['rotaxane 9']}]} | |
90 | ['12X=Bn,n=1', '13X=Bn,n=2', '14X=Ph,n=2', 'isophthaloyldichloride', 'p-xylenediamine', 'CHCl3', 'NEt3', 'NH HN', 'NH HN', 'NH HN', '15X=Bnn=1,8%', '16X=Bnn=2,17%', '17X=Ph.n=2.40%'] | {'NEt3': [{'substrate': ['isophthaloyldichloride', 'p-xylenediamine'], 'products': ['12X=Bn,n=1', '13X=Bn,n=2', '14X=Ph,n=2']}], 'CHCl3': [{'substrate': ['12X=Bn,n=1', '13X=Bn,n=2', '14X=Ph,n=2'], 'products': ['15X=Bnn=1,8%', '16X=Bnn=2,17%', '17X=Ph.n=2.40%']}]} | |
91 | ['+', 'HN', '108', '109', 'tBu', '107', 'CHCI3', '45%', 'Bu', 'tBu', 'HN', '110', 'tBU'] | {'Nitrone-maleimide stoppering reaction': [{'substrate': ['108', '109', '107'], 'products': ['110']}]} | |
92 | ['CF', '117', 'CF3', '90', '118', 'Cu(CH3CN)4BF4', 'CH2Cl2', 'TBTA', 'DIPEA', '47%', 'VH', 'HN', 'F3C', 'NEN', '119', '(b)', 'NH', 'HN', 'F3C', 'N=N', '120'] | {'Cu(CH3CN)4BF4': [{'substrate': ['CF3', '90', '118'], 'products': ['CF', '117', '119']}], 'TBTA': [{'substrate': ['119'], 'products': ['120']}], 'DIPEA': [{'substrate': ['120'], 'products': ['NH', 'HN', 'F3C', 'N=N']}]} | |
93 | ['B', 'Hemiketal Mechanism', 'Hydride-transfer Mechanism', 'Coupled proton-hydride transfer', 'CO2H', 'CO2H', 'HO2C', 'HN', 'HOC', 'HN', 'hydride transfer', 'MeO', 'OMe', 'tBu', 'proton coupled', 'o-Q', 'electron transfer', 'o-Q', 'Asp', 'Asp', 'CO2Me', 'CO2Me', 'CO2Me', 'MeO2C', 'HN', 'MeO2C', 'HN', 'MeO2C', 'HN', '+ ... | {'Hemiketal Mechanism': [{'substrate': ['EtOH', 'DBU'], 'products': ['MeCHO', 'Acetaldehyde']}], 'Hydride-transfer Mechanism': [{'substrate': ['4-methyl benzyl alcohol'], 'products': ['MeCHO']}], 'Coupled proton-hydride transfer': [{'substrate': ['benzylic alcohol'], 'products': ['MeCHO']}]} | |
94 | ['100', '90', '80-', '70', 'Ba2+', '-09', 'Ca2+', '50-', "'ield", 'La3+', '40', 'Lu3+', '30', '20-', '10-', '0', '0', '200', '400', '600', '800', '1000', '1200', '1400', 'Time (min)'] | {'PQQMe2-1-aza-15-crown-5': [{'substrate': ['4-methyl benzyl alcohol'], 'products': ['4Me-PhCHO']}], 'Ba(OTf)2': [{'substrate': ['4-methyl benzyl alcohol'], 'products': ['4Me-PhCHO']}], 'Ca(OTf)2⋅H2O': [{'substrate': ['4-methyl benzyl alcohol'], 'products': ['4Me-PhCHO']}], 'Ln(OTf)3⋅3\u2009H2O': [{'substrate': ['4-met... | |
95 | ['A)', '1143', '1114', '80s', '100ms', '1104', '1800', 'v/cm-', '950', 'B)', 'Mg', 'Lys 16', 'Arg'] | {'GAP': [{'substrate': ['GTP'], 'products': ['GDP', 'Pi']}]} | |
96 | ['CHO', 'COOH', 'H', '-OH', 'H-', '-OH', 'HO', '-H', 'GOx', 'HO', '-H', '+02', 'H', 'OH', 'H', 'OH', 'H', 'OH', 'H', 'OH', 'CH2OH', 'CHOH', 'Glucose', 'Gluconic acid', 'NH2', 'HO2', 'TMB', '+', '?', 'H2N', 'NH2', 'Porphyrin Nanocomposite', 'HO', 'oXTMB'] | {'Glucose Oxidase': [{'substrate': ['Glucose'], 'products': ['Gluconic acid', 'H2O2']}], 'Porphyrin Nanocomposite': [{'substrate': ['H2O2'], 'products': ['TMB', 'oXTMB']}]} | |
97 | ['H2O', 'H', '-OPP-', 'FPP', 'C. intybus', 'ZmEDS', 'JH', 'OH', 'OH', 'HO', '12', '13', 'B)', 'HO', 'H+', 'H', 'OF', '+-', '14', '15', 'OH', '16'] | {'Cichorium intybus': [{'substrate': ['1'], 'products': ['12']}], 'ZmEDS': [{'substrate': ['1'], 'products': ['13']}], 'Acid-catalysed reaction': [{'substrate': ['1'], 'products': ['14', '15', '16']}]} | |
98 | ['H', 'H', 'H', 'OH', 'OH', 'HO', 'OH', 'L1', 'L2', 'L3', 'L4', '0', 'F', 'H+', '10', '(-)-1', 'OH', 'H', 'H', 'OH', 'OH', 'OH', 'OH', 'L5', 'L6', 'L7', 'L8'] | {'H+': [{'substrate': ['Hedycaryol'], 'products': ['L1', 'L2', 'L3', 'L4', 'L5', 'L6', 'L7', 'L8']}]} | |
99 | ['OH', 'SalAI-SalAIX', 'PKS', 'OF', 'Salc', 'OF', 'SalD', '(SalE)', 'OF', 'SalB enzymes', 'OH', 'OH', 'chain', 'chain', 'release', 'release', '3'] | {'SalE': [{'substrate': ['SalAI-SalAIX', 'Salc'], 'products': ['SalD', '3']}], 'PKS': [{'substrate': ['SalAI-SalAIX'], 'products': ['Salc']}], 'SalB': [{'substrate': ['SalD'], 'products': ['OH', 'chain', 'release']}]} |
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