DrugBank ID stringlengths 7 7 | Accession Numbers stringlengths 7 102 ⌀ | Common name stringlengths 3 226 | CAS stringlengths 7 12 ⌀ | UNII stringlengths 10 10 ⌀ | Synonyms stringlengths 2 1.48k ⌀ | Standard InChI Key stringlengths 27 27 ⌀ |
|---|---|---|---|---|---|---|
DB02431 | EXPT01053 | Cytidine-5'-Triphosphate | 65-47-4 | K0118UX80T | null | PCDQPRRSZKQHHS-XVFCMESISA-N |
DB02432 | EXPT00339 | RU90395 | null | null | null | RLLAUERCSKPFGD-VMPREFPWSA-N |
DB02433 | EXPT02492 | {[(2,2-Dihydroxy-Ethyl)-(2,3,4,5-Tetrahydroxy-6-Phosphonooxy-Hexyl)-Amino]-Methyl}-Phosphonic Acid | null | null | null | ATILYNKCRYHYEP-SQEXRHODSA-N |
DB02434 | EXPT00230 | 4-(2-Thienyl)Butyric Acid | 4653-11-6 | VLB4C9G6WY | null | VYTXLSQVYGNWLV-UHFFFAOYSA-N |
DB02435 | EXPT00505 | Aminomethylcyclohexane | 3218-02-8 | null | null | AVKNGPAMCBSNSO-UHFFFAOYSA-O |
DB02436 | EXPT01899 | {4-[(2S)-2-({[(1S)-1-Carboxy-2-phenylethyl]carbamoyl}amino)-3-oxo-3-(pentylamino)propyl]phenoxy}malonic acid | null | BSW3GP3Z2B | null | BKONADSQADEJJP-SFTDATJTSA-N |
DB02437 | EXPT02012 | (5r)-5-Amino-6-Hydroxyhexylcarbamic Acid | null | null | null | XHKWPAAHPLALGC-LURJTMIESA-N |
DB02438 | EXPT00180 | 3-O-Methylfructose in Linear Form | null | null | null | OFSVCCCZZQKHKQ-QPPQHZFASA-N |
DB02441 | EXPT00650 | 2-Butyl-5,6-Dihydro-1h-Imidazo[4,5-D]Pyridazine-4,7-Dione | null | 917N15H9XX | null | DQHJYYALMHIEAH-UHFFFAOYSA-N |
DB02442 | EXPT02935 | Dioxyselenocysteine | null | null | null | LQMXQNUAKTVFAG-REOHCLBHSA-N |
DB02443 | EXPT02130 | Methicillin Acyl-Serine | null | null | null | GFYFFUGNPVBDAK-ZHBCMPEGSA-L |
DB02445 | EXPT00457 | 2-Deoxy-2-Amino Glucitol-6-Phosphate | null | null | null | LBNVXZROMBUNNQ-SLPGGIOYSA-N |
DB02446 | EXPT01737 | Glutamine hydroxamate | 1955-67-5 | null | gamma-Glutamyl hydroxamate | Glutamate-gamma-hydroxamate | Glutamate-gamma-hydroxamic acid | Glutamic acid gamma-monohydroxamate | Glutamyl-gamma-hydroxamate | L-gamma-Glutamyl hydroxamate | L-glutamic acid γ-hydroxamic acid | YVGZXTQJQNXIAU-VKHMYHEASA-N |
DB02447 | EXPT01598 | 3,8,9,10-tetrahydroxy-7-hydroxymethyl-6-oxa-1,3-diaza-spiro[4.5]decane-2,4-dione | null | null | null | IHDZZZHACPJCFJ-WWHASAIZSA-N |
DB02448 | EXPT03028 | N-Tridecanoic Acid | 638-53-9 | 19936LIY2V | null | SZHOJFHSIKHZHA-UHFFFAOYSA-N |
DB02449 | EXPT01260 | 3-(1h-Indol-3-Yl)-2-[4-(4-Phenyl-Piperidin-1-Yl)-Benzenesulfonylamino]-Propionic Acid | null | null | null | ULOTXPTWJAUGGE-MHZLTWQESA-N |
DB02450 | EXPT00786 | 2-Benzo[1,3]Dioxol-5-Ylmethyl-3-Benzyl-Succinic Acid | null | null | null | ASEJDWRSZYAIOT-GJZGRUSLSA-N |
DB02451 | EXPT00730 | B-nonylglucoside | 69984-73-2 | Q5TS785PG5 | null | QFAPUKLCALRPLH-UXXRCYHCSA-N |
DB02452 | EXPT03131 | Thymidine 5'-triphosphate | 365-08-2 | QOP4K539MU | 2'-deoxythymidine triphosphate | 5'-TTP | deoxy-TTP | dTTP | pppdT | Thymidine-5'-triphosphate | NHVNXKFIZYSCEB-XLPZGREQSA-N |
DB02453 | EXPT02857 | Antimonous acid | null | null | Stiborous acid | Trihydroxyantimonite(III) | SZOADBKOANDULT-UHFFFAOYSA-K |
DB02454 | EXPT01386 | 5-(6-Amino-9h-Purin-9-Yl)-4-Hydroxytetrahydrofuran-3-Yl Dihydrogen Phosphate | null | null | null | IJEJRDCFMFEDGL-AFEQZKEHSA-N |
DB02455 | EXPT01443 | Fluoresceinylthioureido | null | null | null | VHJFQSRUDVDTEO-UHFFFAOYSA-N |
DB02456 | EXPT00831 | Aracytidine 5'-monophosphate | 7075-11-8 | Y73692GHI4 | 1-beta-D-Arabinofuranosylcytosine 5'-phosphate | Ara-5'-CMP | Aracytidine 5'-phosphate | Cytosine arabinose-5'-phosphate | Cytosine arabinoside 5'MP | Cytosine arabinoside monophosphate | IERHLVCPSMICTF-CCXZUQQUSA-N |
DB02457 | EXPT00797 | Undecyl-Phosphinic Acid Butyl Ester | null | null | null | QCBLJDSWVGAXQB-UHFFFAOYSA-N |
DB02458 | EXPT01572 | DB04412 | S-(2,4-dinitrophenyl)glutathione | 26289-39-4 | HL4G8D2C8T | dinitrophenyl-S-glutathione | DNP-S-glutathione | DNP-SGc | FXEUKVKGTKDDIQ-UWVGGRQHSA-N |
DB02459 | EXPT01553 | 4-guanidinobenzoic acid | 16060-65-4 | XFP29CVC4Z | 4-Guanidino-benzoic acid | p-guanidinobenzoic acid | SXTSBZBQQRIYCU-UHFFFAOYSA-N |
DB02460 | EXPT00986 | Hydrogenobyrinic acid | 23599-55-5 | null | Hydrogenobyrinate | Hydrogenobyrinic acid | Hydrogenobyrinsäure | MYMATQFDUQLSCD-IPUCCYEASA-N |
DB02461 | EXPT01078 | S-Methyl Phosphocysteine | null | R021QK26O0 | null | IIALWEPLPCANHU-VKHMYHEASA-N |
DB02462 | EXPT01399 | Thiocoumarin | null | CM773J3THB | null | DIOZFKOOIBATNZ-UHFFFAOYSA-N |
DB02463 | EXPT00018 | 2-(2-Hydroxy-Phenyl)-1h-Indole-5-Carboxamidine | null | null | null | JPGNPKIYCTXJPG-UHFFFAOYSA-O |
DB02464 | EXPT00400 | Benzylamine | 100-46-9 | A1O31ROR09 | null | WGQKYBSKWIADBV-UHFFFAOYSA-N |
DB02465 | EXPT02119 | Methoxy arachidonyl fluorophosphonate | 180509-15-3 | null | MAFP | Methoxy arachidonyl fluorophosphonate | Methyl arachidonylfluorophosphonate | KWKZCGMJGHHOKJ-WTIHWRCNSA-N |
DB02466 | EXPT00042 | BMS-181156 | 110368-35-9 | C9FL8WH6S4 | (E)-4-(3-Oxo-3-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-1-propenyl)benzoic acid | ZXQHMEUGMCXKLO-KPKJPENVSA-N |
DB02467 | EXPT02173 | L-methionine (S)-S-oxide | null | null | null | QEFRNWWLZKMPFJ-MFXDVPHUSA-N |
DB02468 | EXPT00073 | 12-Phenylheme | null | null | null | ULDWFUFUNJMSCJ-ZXHVEAKLSA-N |
DB02469 | EXPT01106 | 4,6-dideoxy-4-amino-beta-D-glucopyranoside | null | null | null | RJKBJEZZABBYBA-VFUOTHLCSA-N |
DB02470 | EXPT02091 | D-Glycero-D-Mannopyranose-7-Phosphate | null | null | null | SDADNVAZGVDAIM-QTNLNCNHSA-N |
DB02471 | EXPT02395 | Nojirimycine Tetrazole | null | null | null | UCJXQRFJERKPOZ-SQOUGZDYSA-N |
DB02472 | EXPT01774 | 7,8-dihydroinosine | null | null | 6-hydroxy-7,8-dihydro purine nucleoside | ZWTNXGIZBOQCAJ-KQYNXXCUSA-N |
DB02473 | EXPT00041 | 6-[N-(1-Isopropyl-3,4-Dihydro-7-Isoquinolinyl)Carbamyl]-2-Naphthalenecarboxamidine | null | null | null | XRHANBWAKSYPEN-UHFFFAOYSA-N |
DB02474 | EXPT00089 | BMSC-0013 | null | null | N-{6-[(Methoxycarbonyl)amino]hexanoyl}-β-D-galactopyranosylamine | YTYAKGJMNHDUDF-UUWLPUTASA-N |
DB02475 | EXPT02527 | Deoxyamidinoproclavaminic acid | null | null | Deoxyamidinoproclavaminate | Deoxyguanidinoproclavaminate | Deoxyguanidinoproclavaminic acid | UYADDEKIZFRINK-LURJTMIESA-N |
DB02477 | EXPT02176 | N-({4-[4-(2-Methyl-1H-imidazol-1-yl)butyl]phenyl}acetyl)-L-seryl-N-(2-cyclohexylethyl)-L-lysinamide | 164931-25-3 | null | null | WHLPIOSHBKQGHA-KYJUHHDHSA-N |
DB02479 | EXPT02859 | (R)-N-(3-Indol-1-Yl-2-Methyl-Propyl)-4-Sulfamoyl-Benzamide | null | null | null | ZFWHOUCRVSOZJE-CQSZACIVSA-N |
DB02480 | EXPT02854 | (S)-4-bromo-3-hydroxy-3-methylbutyl diphosphate | null | null | null | YKAYCWPQDPILSA-YFKPBYRVSA-N |
DB02481 | EXPT00729 | N-Benzylformamide | 6343-54-0 | L363D92ELK | null | IIBOGKHTXBPGEI-UHFFFAOYSA-N |
DB02482 | EXPT03092 | Phosphonothreonine | null | null | null | USRGIUJOYOXOQJ-STHAYSLISA-N |
DB02483 | EXPT01343 | Etheno-NAD | null | null | null | JCDBQDNBEQHDHK-BSLNIGMPSA-N |
DB02484 | EXPT00805 | Cytidine 5'-diphosphoglycerol | null | null | null | HHPOUCCVONEPRK-CNYIRLTGSA-N |
DB02485 | EXPT02309 | Cytidine-5'-Monophosphate-5-N-Acetylneuraminic Acid | null | T8I6M8AXA0 | null | TXCIAUNLDRJGJZ-BILDWYJOSA-N |
DB02486 | EXPT01723 | 2-Hydroxyethyl Disulfide | 1892-29-1 | 45543L74BS | null | KYNFOMQIXZUKRK-UHFFFAOYSA-N |
DB02488 | EXPT01009 | 1-(2-Ethanone)-2-Hydroxy-2-(1-Amino-2-Methyl-2-Ethanol)-4-(2-Dimethyl)Ethane-Imidazoline-5-One;Chromophore (Thr-Leu-Gly) | null | null | null | WOCXRZLDLXIZRL-UBHAPETDSA-N |
DB02489 | EXPT00360 | 9-Methylguanine | 5502-78-3 | 397W61ZHWY | null | UUWJNBOCAPUTBK-UHFFFAOYSA-N |
DB02490 | EXPT01907 | (Diaminomethyl-Methyl-Amino)-Acetic Acid | null | null | null | YNHURFGTTODJOO-UHFFFAOYSA-N |
DB02491 | EXPT00378 | 4-[4-(1-Amino-1-Methylethyl)Phenyl]-5-Chloro-N-[4-(2-Morpholin-4-Ylethyl)Phenyl]Pyrimidin-2-Amine | null | null | null | CJSSYVIHFXDFFC-UHFFFAOYSA-N |
DB02492 | EXPT01590 | Ghavamiol | null | null | null | YWOSRVQDYDWMAB-JBXPSPKUSA-K |
DB02493 | EXPT01683 | DB02150 | Hydantocidin-5'-phosphate | null | null | [(5S,7R,8S,9R)-8,9-dihydroxy-2,4-dioxo-6-oxa-1,3-diazaspiro[4.4]non-7-yl]methyl dihydrogen phosphate | Phosphohydantocidin | HVXIMXHBUJADCC-GTBMBKLPSA-N |
DB02494 | EXPT01733 | (S)-3-phenyllactic acid | 20312-36-1 | KW7SNV9X8B | alpha-hydroxy-beta-phenyl-propionic acid | L-(−)-3-phenyllactic acid | L-3-phenyllactic acid | L-beta-Phenyllactic acid | L-β-phenyllactic acid | VOXXWSYKYCBWHO-QMMMGPOBSA-N |
DB02495 | EXPT00745 | 9-(4-hydroxybutyl)-N2-phenylguanine | null | A52TG78T53 | HBPG | JHBXNPBKSPYOFT-UHFFFAOYSA-N |
DB02496 | EXPT01308 | 1-Deoxy-D-xylulose 5-phosphate | 190079-18-6 | I4C288B3TN | null | AJPADPZSRRUGHI-RFZPGFLSSA-N |
DB02497 | EXPT01649 | L-Alpha-Glycerophosphorylserine | null | null | null | ZWZWYGMENQVNFU-UHNVWZDZSA-N |
DB02498 | EXPT00963 | Carba-nicotinamide-adenine-dinucleotide | null | null | null | DGPLSUKWXXSBCU-VGXGLJSLSA-O |
DB02499 | EXPT01209 | Dinor-N(Omega)-Hydroxy-L-Arginine | null | null | null | RPHCSGPGZUWMRV-REOHCLBHSA-N |
DB02500 | EXPT00866 | 6-(Dihydroxy-Isobutyl)-Thymine | null | null | 6-(1,3-dihydroxyisobutyl)thymine | 6-(Dihydroxyisobutyl)-Thymine | CLCPDSJUXHDRGX-UHFFFAOYSA-N |
DB02501 | EXPT02979 | N(2)-succinyl-L-arginine | null | null | N2-Succinyl-L-arginine | Succinyl-arginine | Succinylarginine | UMOXFSXIFQOWTD-LURJTMIESA-N |
DB02502 | EXPT00333 | 8-hydroxy-2'-deoxyguanosine | 88847-89-6 | 4RGB38T3IB | 8-Hydroxydeoxyguanosine | 8-OHdG | 8-Oxo-7,8-dihydro-2'-deoxyguanosine | 8-Oxo-dG | 8-Oxoguanosine | HCAJQHYUCKICQH-VPENINKCSA-N |
DB02503 | EXPT01061 | 4-(Carboxyvin-2-Yl)Phenylboronic Acid | null | null | null | IEMLKNHGGSYOMP-ZZXKWVIFSA-N |
DB02504 | EXPT00335 | [3-(1-Benzyl-3-Carbamoylmethyl-2-Methyl-1h-Indol-5-Yloxy)-Propyl-]-Phosphonic Acid | null | null | null | AQEYCNKFBRLUOT-UHFFFAOYSA-N |
DB02505 | EXPT01851 | N-(R-Carboxy-Ethyl)-Alpha-(S)-(2-Phenylethyl) | null | null | null | JJVQUUYZGJWBPW-UHFFFAOYSA-N |
DB02506 | EXPT00428 | 2,6,8-Trimethyl-3-Amino-9-Benzyl-9-Methoxynonanoic Acid | null | null | null | SWTFXINHZPXNOX-DZBHQSCQSA-N |
DB02508 | EXPT01922 | Isopentyl Pyrophosphate | null | null | null | IPFXNYPSBSIFOB-UHFFFAOYSA-N |
DB02509 | EXPT01466 | Farnesol | 4602-84-0 | J03523NK03 | null | CRDAMVZIKSXKFV-FBXUGWQNSA-N |
DB02510 | EXPT02481 | 5'-O-(L-Prolylsulfamoyl)adenosine | null | null | null | LKVJEMXWEODCAY-JVEUSOJLSA-N |
DB02511 | EXPT02304 | 2-Hydroxy-5-({1-[(2-Naphthyloxy)Methyl]-3-Oxoprop-1-Enyl}Amino)Tyrosine | null | null | 2-Hydroxy-5-{[(2E)-1-(2-naphthyloxy)-4-oxo-2-buten-2-yl]amino}-L-tyrosine | PZWMZAFFUAWVDN-CQXYXCHQSA-N |
DB02512 | EXPT00120 | 1,6-Fructose Diphosphate (Linear Form) | null | null | null | XPYBSIWDXQFNMH-PQLUHFTBSA-N |
DB02513 | EXPT01913 | Thymol | 89-83-8 | 3J50XA376E | 2-isopropyl-5-methylphenol | 5-Methyl-2-(1-Methylethyl)Phenol | IPMP | MGSRCZKZVOBKFT-UHFFFAOYSA-N |
DB02514 | EXPT00995 | (2Z)-3-{[Oxido(oxo)phosphoranyl]oxy}-2-phenylacrylate | 2007-07-0 | null | null | WSMRUPUEYOBWRC-VURMDHGXSA-M |
DB02515 | EXPT01531 | sn-glycerol 3-phosphate | 17989-41-2 | 370V52HE4B | (R)-glycerol 1-phosphate | D-(glycerol 1-phosphate) | D-Glycerol 1-phosphate | Glycerol-3-phosphate | Glycerophosphoric acid | L-(glycerol 3-phosphate) | Phosphoric acid mono-((R)-2,3-dihydroxy-propyl) ester | Phosphorsäure-mono-((R)-2,3-dihydroxy-propylester) | sn-Glycerol 3-phosphate | AWUCVROLDVIAJX-GSVOUGTGSA-N |
DB02516 | EXPT00863 | (R)-carnitinyl-CoA betaine | null | null | (R)-carnitinyl-CoA βine | L-carnitinyl-CoA betaine | R-carnitinyl-CoA inner salt | BBRISSLDTUHWKG-PVMHLSDZSA-N |
DB02517 | EXPT01180 | D-Glutamic Acid | 6893-26-1 | Q479989WEA | null | WHUUTDBJXJRKMK-GSVOUGTGSA-N |
DB02518 | EXPT00596 | N-Acetylalanine | 97-69-8 | 26C4VY6Z0M | (S)-2-(acetylamino)propanoic acid | 2-acetamidopropionic acid | Ac-Ala-OH | Acetylalanine | L-N-Acetylalanine | N-acetyl-L-alanine | N-acetyl-L-α-alanine | N-Acetyl-S-alanine | s-(-)-n-acetylalanine | KTHDTJVBEPMMGL-VKHMYHEASA-N |
DB02519 | EXPT01891 | Indirubin-5-sulphonate | 244021-67-8 | null | null | IHBOEHLUIBMBMY-YPKPFQOOSA-N |
DB02520 | EXPT01132 | Ditiocarb | 147-84-2 | 99Z2744345 | diethyl dithiocarbamate | diethyl-dithiocarbamate | diethylcarbamodithioic acid | diethyldithiocarbamate | diethyldithiocarbamic acid | LMBWSYZSUOEYSN-UHFFFAOYSA-N |
DB02521 | EXPT01448 | Flaviolin | 479-05-0 | TH7ZC8J7OE | 2,5,7-Trihydroxy-1,4-naphthalenedione | 2,5,7-trihydroxynaphthoquinone | RROPNRTUMVVUED-UHFFFAOYSA-N |
DB02522 | EXPT02646 | Phosphonopyruvate | null | AQ57DYF7MV | null | CHDDAVCOAOFSLD-UHFFFAOYSA-N |
DB02523 | EXPT00380 | 2-aminooxyethyl-[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]-methyl-sulfonium | null | null | null | RMAOLICYOBWFLA-OCVRIJAPSA-N |
DB02524 | EXPT00019 | 2',3'-O-{4-[Hydroxy(oxido)-λ5-azanylidene]-2,6-dinitro-2,5-cyclohexadiene-1,1-diyl}adenosine 5'-(tetrahydrogen triphosphate) | null | null | null | XFMMHXLUHKBKQE-UHEGPQQHSA-N |
DB02525 | EXPT01656 | D-galactohydroximo-1,5-lactam | null | null | null | VBXHGXTYZGYTQG-MGCNEYSASA-N |
DB02526 | EXPT00270 | CRA_10655 | null | null | null | WCFWDBPDMBXMTQ-UHFFFAOYSA-N |
DB02527 | EXPT00959 | Cyclic adenosine monophosphate | 60-92-4 | E0399OZS9N | 3',5'-cyclic AMP | Adenosine 3',5'-cyclic monophosphate | Adenosine 3',5'-cyclic phosphate | Adenosine 3',5'-phosphate | AMPC | cAMP | Cyclic adenylic acid | Cyclic AMP | IVOMOUWHDPKRLL-KQYNXXCUSA-N |
DB02528 | EXPT02402 | Tetrazolyl Histidine | null | null | null | OOFNCFXOGMDAEN-YFKPBYRVSA-N |
DB02529 | EXPT01524 | (2R,4S,5R,6R)-5-Acetamido-4-amino-6-(diethylcarbamoyl)oxane-2-carboxylic acid | null | null | null | BULFTXGJKXVMER-LNFKQOIKSA-N |
DB02530 | EXPT00402 | DB08850 | gamma-Aminobutyric acid | 56-12-2 | 2ACZ6IPC6I | 4-aminobutanoic acid | 4-aminobutyric acid | 4Abu | GABA | gamma-Aminobutyric acid | piperidic acid | piperidinic acid | γ-amino-n-butyric acid | γ-aminobutanoic acid | γ-Aminobuttersäure | γ-aminobutyric acid | ω-aminobutyric acid | BTCSSZJGUNDROE-UHFFFAOYSA-N |
DB02531 | EXPT01932 | DB04305 | Isobutyric acid | 79-31-2 | 8LL210O1U0 | 2-methyl-propionic acid | 2-Methylpropanoate | 2-Methylpropanoic acid | 2-Methylpropionsäure | 2,2-dimethylacetic acid | Dimethylacetic acid | iso-butyric acid | Isobutanoate | Isobuttersäure | Isobutyrate | Isopropylformic acid | α-isobutyric acid | α-methylpropanoic acid | α-methylpropionic acid | KQNPFQTWMSNSAP-UHFFFAOYSA-N |
DB02532 | EXPT03006 | 2,4,6-Triaminoquinazoline | null | WZD2M6Q8CC | null | LJBWEZVYRBKOCI-UHFFFAOYSA-N |
DB02534 | EXPT00127 | 2-Allylphenol | 1745-81-9 | O04F145ZJZ | null | QIRNGVVZBINFMX-UHFFFAOYSA-N |
DB02535 | EXPT01328 | Aminodi(Ethyloxy)Ethylaminocarbonylbenzenesulfonamide | null | P7AMK4J5SW | null | QGGYVKRXFQLYQD-UHFFFAOYSA-N |
DB02536 | EXPT00170 | D-glyceraldehyde | 453-17-8 | 41A680M0WB | D-(+)-glyceraldehyde | D-2,3-dihydroxypropanal | D-2,3-dihydroxypropionaldehyde | D-aldotriose | D-glycerose | Triose | MNQZXJOMYWMBOU-VKHMYHEASA-N |
DB02537 | EXPT02126 | 2-Hydroxy-5-({1-[(4-Methylphenoxy)Methyl]-3-Oxoprop-1-Enyl}Amino)-L-Tyrosine | null | null | null | FSNBWEOGSXUNGF-CQMBDMNQSA-N |
DB02538 | EXPT01718 | N-[4-(2-Methylimidazo[1,2-a]Pyridin-3-Yl)-2-Pyrimidinyl]Acetamide | null | null | null | ZCRPPLDDHBLUES-UHFFFAOYSA-N |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.