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
DB04470
EXPT00271
CRA_10656
null
null
null
HSHVHNIOQTZSOQ-UHFFFAOYSA-N
DB04471
EXPT02683
2-Phenyl-1-[4-(2-Piperidin-1-Yl-Ethoxy)-Phenyl]-1,2,3,4-Tetrahydro-Isoquinolin-6-Ol
null
null
null
FMWVCTJKLAVRPB-MUUNZHRXSA-N
DB04472
EXPT02812
(R)-1-Para-Nitro-Phenyl-2-Azido-Ethanol
null
null
null
DHEGJYKMZJGYGW-QMMMGPOBSA-N
DB04473
EXPT00452
alpha-L-fucose
6696-41-9
OF086I9H7W
α-L-Fuc | α-L-fucose | α-L-Fucp
SHZGCJCMOBCMKK-SXUWKVJYSA-N
DB04474
EXPT00103
8-anilinonaphthalene-1-sulfonic acid
82-76-8
630I4V6051
1-(phenylamino)-8-naphthalenesulfonic acid | 1-Anilino-8-naphthalenesulfonate | 1-anilino-8-naphthalenesulfonic acid | 8-Anilino-1-naphthalene sulfonic acid | 8-anilinonaphthalene-1-sulphonic acid
FWEOQOXTVHGIFQ-UHFFFAOYSA-N
DB04476
EXPT01118
Trencam-3,2-Hopo
null
Z33JA2LC96
null
QCIDBNKTKNBPKM-UHFFFAOYSA-N
DB04477
EXPT03076
2'-Deoxy-2'-[(3,5-dimethoxybenzoyl)amino]-N-[(1R)-1,2,3,4-tetrahydro-1-naphthalenyl]adenosine
null
null
N-1,2,3,4-Tetrahydronaphth-1-yl-2'-[3,5-dimethoxybenzamido]-2'-deoxy-adenosine
FDZQGEIYGFPMOB-ZUURFMEUSA-N
DB04478
EXPT00235
Cp-166572, 2-Hydroxymethyl-4-(4-N,N-Dimethylaminosulfonyl-1-Piperazino)-Pyrimidine
null
ZI4EMQ9WYE
null
XDTHNROWHAAVPJ-UHFFFAOYSA-N
DB04479
EXPT02349
4-Nitro-Inden-1-One
null
null
null
UUNZJPCKMDLQPO-UHFFFAOYSA-N
DB04480
EXPT00236
3-(4-Fluorophenyl)-2-(6-Methylpyridin-2-Yl)-5,6-Dihydro-4h-Pyrrolo[1,2-B]Pyrazole
null
null
null
NBDZLUOYAAVYHF-UHFFFAOYSA-N
DB04481
EXPT02232
Erythritol
149-32-6
RA96B954X6
(2R,3S)-butane-1,2,3,4-tetrol | Erythrit | Erythrite | Erythritol | Erythro-tetritol | Erythrol | L-erythritol | Mesoerythritol | Phycite | Phycitol
UNXHWFMMPAWVPI-ZXZARUISSA-N
DB04482
EXPT00957
Cmp-2-Keto-3-Deoxy-Octulosonic Acid
null
null
null
YWWJKULNWGRYAS-UOVSKDHASA-N
DB04483
EXPT02121
2-deoxy-2-fluoro-β-D-mannose
55449-80-4
null
2-deoxy-2-fluoro-beta-D-mannose
ZCXUVYAZINUVJD-AIECOIEWSA-N
DB04484
EXPT02590
L-phenylalaninol
3182-95-4
9GE9QOP0ET
null
STVVMTBJNDTZBF-VIFPVBQESA-N
DB04485
EXPT03053
Thymidine
50-89-5
VC2W18DGKR
2'-deoxy-5-methyluridine | 2'-deoxythymidine | 2'-thymidine | Deoxyribosylthymine | Deoxythymidine | dThd | Thymidine | Thymine 2'-deoxyriboside | Thymine deoxyriboside
IQFYYKKMVGJFEH-XLPZGREQSA-N
DB04486
EXPT01745
(2s)-2,8-Diaminooctanoic Acid
null
null
null
KMPBBRFCAYFTMR-ZETCQYMHSA-N
DB04487
EXPT02181
N-Methylleucine
31321-74-1
RS2PMV5S1P
null
XJODGRWDFZVTKW-ZCFIWIBFSA-N
DB04488
EXPT01675
(6S)-N-[(2S,3R,6R,7R)-3-(Acetyloxymethyl)-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]octan-7-yl]-6-[(2-aminoacetyl)amino]-7-hydroxy-7-oxoheptanimidate
null
null
null
JDAREAJBQYNCGO-UPMYTKPLSA-M
DB04489
EXPT01581
Guanidinoethylmercaptosuccinic acid
77482-44-1
null
GEMSA
VKVCLXDFOQQABP-BYPYZUCNSA-N
DB04490
EXPT02713
3-(Mercaptomethylene)Pyridine
null
YGR16Z02P2
null
MBXKCLHOVPXMCJ-UHFFFAOYSA-N
DB04491
EXPT01171
Diisopropylphosphono Group
null
676G4RQ6ND
null
BLKXLEPPVDUHBY-UHFFFAOYSA-N
DB04492
EXPT02336
2-(acetylamino)-2-deoxy-4-O-sulfo-alpha-D-galactopyranose
null
null
null
WHCJUIFHMJFEFZ-YQXRAVKXSA-N
DB04493
EXPT01383
Fructose-6-phosphate
643-13-0
2012QM764Y
D-Fructose 6-phosphate | D-Fructose 6-phosphoric acid | keto-D-fructose 6-phosphate | Neuberg ester
GSXOAOHZAIYLCY-HSUXUTPPSA-N
DB04494
EXPT02435
Dihydroxy(oxo)molybdenum(6+)
null
null
null
GKDPEXRCAVYDOG-UHFFFAOYSA-L
DB04495
EXPT00324
Paratoulene phosphate
null
null
null
GGPXNASQNUOIPB-NSOVKSMOSA-N
DB04496
EXPT02772
4-Phospho-D-erythronohydroxamic acid
718599-64-5
null
null
JJQQOJRGUHNREK-PWNYCUMCSA-N
DB04497
EXPT00548
2'-Monophosphoadenosine-5'-Diphosphoribose
null
null
null
QHNQLFGTVLWISK-MQSGHBOVSA-O
DB04498
EXPT00566
Aspartate Semialdehyde
null
null
null
HOSWPDPVFBCLSY-GSVOUGTGSA-N
DB04499
EXPT02820
(R)-styrene oxide
20780-53-4
0HB27D5MRW
(R)-(+)-styrene oxide | (R)-(epoxyethyl)benzene | R-phenyloxirane | R-styrene oxide
AWMVMTVKBNGEAK-QMMMGPOBSA-N
DB04500
EXPT03145
Acedoben
556-08-1
04Z20NMK31
4-(Acetylamino)benzoic acid | 4-acetamidobenzoic acid | 4-Acetylaminobenzoic acid | 4-Carboxyacetanilide | Acedoben | Acedobene | Acedobenum | N-Acetyl-p-aminobenzoic acid | N-Acetyl-PABA | p-Acetamidobenzoic acid | p-Acetoaminobenzoic acid | p-Acetylaminobenzoic acid | PAAB | Para acetamido benzoic acid
QCXJEYYXVJIFCE-UHFFFAOYSA-N
DB04501
EXPT00824
Camphane
464-15-3
null
(1s,4s)-1,7,7-trimethylbicyclo[2.2.1]heptane | 1β,4β-bornane | Bornane | Bornylane
BEWYHVAWEKZDPP-WAAGHKOSSA-N
DB04502
EXPT03235
WRR-204
null
null
Phenyl (3S)-3-({N-[(benzyloxy)carbonyl]-L-phenylalanyl}amino)-5-phenyl-1-pentanesulfonate
SUGQHICXCRBQOI-CDZUIXILSA-N
DB04503
EXPT03086
Sp-722
null
null
null
NDDOUBGQRWFVQM-QWHCGFSZSA-N
DB04504
EXPT03253
(3s)-2,3,4,5-Tetrahydropyridin-3-Amine
null
null
null
SEECZTVWJNGUEJ-RXMQYKEDSA-N
DB04505
EXPT02699
8-(2-Chloro-3,4,5-Trimethoxy-Benzyl)-9-Pent-4-Ylnyl-9h-Purin-6-Ylamine
null
null
null
WUJFGZAAFADPSF-UHFFFAOYSA-N
DB04506
EXPT00908
Chlorophyll B
519-62-0
5712ZB110R
null
NSMUHPMZFPKNMZ-VBYMZDBQSA-M
DB04508
EXPT03243
Methyl(6s)-1-Thio-L-Manno-Hexodialdo-6,2-Pyranoside
null
null
null
RAZJTJNGLFDKPL-VOQCIKJUSA-N
DB04509
EXPT02359
N-Methylnaloxonium
null
null
null
PCSQOABIHJXZMR-YNUHATHGSA-O
DB04510
EXPT00187
3-phospho-D-glyceric acid
820-11-1
null
3-Phospho-(R)-glycerate | 3-phospho-D-glycerate | 3-Phosphoglycerate | D-glycerate 3-phosphate
OSJPPGNTCRNQQC-UWTATZPHSA-N
DB04511
EXPT02922
N-Succinyl Methionine
null
null
null
CZFFMUMOBDIXJU-ZCFIWIBFSA-N
DB04512
EXPT02668
2-Isobutyl-3-methoxypyrazine
24683-00-9
S327O0T12O
3-Isobutyl-2-methoxypyrazine
UXFSPRAGHGMRSQ-UHFFFAOYSA-N
DB04513
EXPT03246
N-(6-Aminohexyl)-5-Chloro-1-Naphthalenesulfonamide
null
null
null
IDEHCMNLNCJQST-UHFFFAOYSA-N
DB04514
EXPT03158
Uridylyl-2'-5'-phospho-guanosine
null
HEM972VB27
null
DFYLLEBFVZTKHD-VMIOUTBZSA-N
DB04515
EXPT02263
2-O-methyl-alpha-L-fucopyranose
1887228-22-9
ZN7HRG4F33
6-deoxy-2-O-methyl-alpha-L-galactopyranose | 6-deoxy-2-O-methyl-α-L-galactopyranose
YLAMTMNJXPWCQN-CXNFULCWSA-N
DB04516
EXPT01174
2-Deoxy-Glucitol-6-Phosphate
null
null
null
KLPBNGZTTQNYHR-PBXRRBTRSA-N
DB04517
EXPT01256
Dipyrromethane Cofactor
null
null
null
LCAXMKQKEYTFDM-UHFFFAOYSA-N
DB04518
EXPT00928
3-[4-(2,4-Dimethyl-Thiazol-5-Yl)-Pyrimidin-2-Ylamino]-Phenol
null
null
null
JJDRRZFRTKZLFT-UHFFFAOYSA-N
DB04519
EXPT02413
Caprylic acid
124-07-2
OBL58JN025
1-heptanecarboxylic acid | Acide octanoïque | Acide octanoique | ácido octanoico | Acidum octanocium | Acidum octanoicum | C8:0 | Caprylic acid | Kaprylsäure | n-caprylic acid | n-octanoic acid | n-Octoic acid | n-octylic acid | Octanoic acid | Octoic acid | Octylic acid
WWZKQHOCKIZLMA-UHFFFAOYSA-N
DB04520
EXPT03139
(3s,8ar)-3-(4-Hydroxybenzyl)Hexahydropyrrolo[1,2-a]Pyrazine-1,4-Dione
null
null
null
LSGOTAXPWMCUCK-RYUDHWBXSA-N
DB04521
EXPT01689
4-S-Glutathionyl-5-pentyl-tetrahydro-furan-2-ol
null
null
GSHNA
ICRIFHIWWXQBPY-JEJJNBGPSA-N
DB04522
EXPT02883
Dexfosfoserine
407-41-0
VI4F0K069V
Dexfosfoserine | Phosphoserine | Serine phosphate
BZQFBWGGLXLEPQ-REOHCLBHSA-N
DB04523
EXPT03026
Tert-Butyl(1s)-1-Cyclohexyl-2-Oxoethylcarbamate
null
null
null
BDSGOSWEKUGHOV-LLVKDONJSA-N
DB04524
EXPT02180
Malonyl-CoA
524-14-1
LNB9YCJ9F9
Coenzyme A, S-(hydrogen propanedioate) | Malonyl coenzyme A | S-(Hydrogen malonyl)coenzyme A
LTYOQGRJFJAKNA-DVVLENMVSA-N
DB04525
EXPT01897
N-(3-Carboxypropanoyl)-L-phenylalanyl-3-carboxy-O-(carboxymethyl)-N-pentyl-L-tyrosinamide
null
null
null
PUAJYWYRZTYQKS-GOTSBHOMSA-N
DB04526
EXPT01620
L-Glycero-D-Manno-Heptopyranose
null
null
null
BGWQRWREUZVRGI-QQABCQGCSA-N
DB04527
EXPT00462
beta-Hydroxyasparagine
20790-72-1
9J17BCS69U
(2S,3S)-3-Hydroxyasparagine
VQTLPSCRBFYDNX-LWMBPPNESA-N
DB04528
EXPT01235
2,4-Dinitrophenol
51-28-5
Q13SKS21MN
Dinitrophenol
UFBJCMHMOXMLKC-UHFFFAOYSA-N
DB04529
EXPT01304
Desvancosaminyl vancomycin
101485-50-1
43WYS9K792
Pseudovancomycin | Vancomycin pseudoaglycone
QCHYVJAUGVHJHX-PZIRYZLHSA-N
DB04530
EXPT00954
S,S-(2-Hydroxyethyl)Thiocysteine
null
7N9D5X3NW4
null
YPUBRSXDQSFQBA-BYPYZUCNSA-N
DB04531
EXPT00643
S-Benzylcysteine
3054-01-1
9VRE13M548
(R)-S-Benzylcysteine | 3-Benzylthioalanine | L-S-Benzylcysteine
GHBAYRBVXCRIHT-VIFPVBQESA-N
DB04532
EXPT01882
Indole
120-72-9
8724FJW4M5
null
SIKJAQJRHWYJAI-UHFFFAOYSA-N
DB04533
EXPT00100
2-Amino-4-methylphenol
95-84-1
9ZV2574SER
2-Amino-p-cresol | 2-Hydroxy-5-methylaniline | 3-Amino-4-hydroxytoluene | 4-Methyl-2-aminophenol
ZMXYNJXDULEQCK-UHFFFAOYSA-N
DB04534
EXPT00255
5-Nitroindazole
5401-94-5
235Y7P37ZD
5-Nitro-1H-indazole
WSGURAYTCUVDQL-UHFFFAOYSA-N
DB04537
EXPT02063
Tryptophanamide
20696-57-5
0K2B9SB26H
(S)-alpha-Amino-1H-indole-3-propionamide | L-tryptophan amide | L-tryptophanamide
JLSKPBDKNIXMBS-VIFPVBQESA-N
DB04538
EXPT00179
threo-3-methyl-L-aspartic acid
6061-13-8
X72YFG5KQE
(3S)-3-methyl-L-aspartic acid | 2S,3S-3-methylaspartic acid | L-threo-3-Methylaspartate
LXRUAYBIUSUULX-HRFVKAFMSA-N
DB04539
EXPT01639
Glyphosate
1071-83-6
4632WW1X5A
null
XDDAORKBJWWYJS-UHFFFAOYSA-O
DB04540
EXPT00945
Cholesterol
57-88-5
97C5T2UQ7J
(3β,14β,17α)-cholest-5-en-3-ol | Cholest-5-en-3beta-ol | Cholesterin | Cholesterol
HVYWMOMLDIMFJA-DPAQBDIFSA-N
DB04541
EXPT01592
Cyclo(prolylglycyl)
97011-16-0
W7O69J5F2B
(S)-Hexahydropyrrolo(1,2-a)pyrazine-1,4-dione-4-17O | Cyclo(pro-gly) | Cyclo(pro-O-gly) | TRANEUROCIN
OWOHLURDBZHNGG-YFKPBYRVSA-N
DB04542
EXPT00601
Zidovudine diphosphate
106060-89-3
K7ZG448V5M
3'-Azido-3'-deoxythymidine 5'-diphosphate | AZTDP
QOYVAFWJURKBJG-XLPZGREQSA-N
DB04543
EXPT00476
2,6-Diamino-8-(1h-Imidazol-2-Ylsulfanylmethyl)-3h-Quinazoline-4-One
null
null
null
CEWKWXPCQGWWBM-UHFFFAOYSA-N
DB04544
EXPT01015
1-Deoxy-1-acetylamino-beta-D-gluco-2-heptulopyranosonamide
null
null
null
BUPVODXECQDZQR-YCOWOFQRSA-N
DB04545
EXPT01847
Afegostat
169105-89-9
G23AP190YS
(3R,4R,5R)-5-(hydroxymethyl)piperidine-3,4-diol | Afegostat | Isofagomine
QPYJXFZUIJOGNX-HSUXUTPPSA-N
DB04546
EXPT00425
3-Deazaadenosine
6736-58-9
037V4520IY
3-deaza-adenosine | Deaza-Ado
DBZQFUNLCALWDY-PNHWDRBUSA-N
DB04547
EXPT00662
Inhibitor BEA409
null
null
null
AJZAPEZJWWQJHC-UWNKZCSISA-N
DB04548
EXPT01554
4-Deoxy-D-Glucuronic Acid
null
null
null
OGDYCNQXUUBOMI-RFPGKLGKSA-N
DB04549
EXPT01902
4-(Aminosulfonyl)-N-[(2,3,4-Trifluorophenyl)Methyl]-Benzamide
null
null
null
AANTYZRUJFNZFI-UHFFFAOYSA-N
DB04551
EXPT01395
beta-D-fructofuranose 1,6-bisphosphate
null
WCH874XLB1
1,6-di-O-phosphono-β-D-fructofuranose | beta-D-Fructose 1,6-bisphosphate | β-D-fructofuranose 1,6-bisphosphate
RNBGYGVWRKECFJ-ARQDHWQXSA-N
DB04552
EXPT02331
Niflumic acid
4394-00-7
4U5MP5IUD8
Acide niflumique | Acido niflumico | Acidum niflumicum | NFA | Niflumic acid
JZFPYUNJRRFVQU-UHFFFAOYSA-N
DB04553
EXPT00126
2-Oxobutanoic Acid
600-18-0
B92RB6HY1A
null
TYEYBOSBBBHJIV-UHFFFAOYSA-N
DB04554
EXPT00401
8-Bromoadenosine-5'-Diphosphate
null
null
null
KVVVTFSHHQCHNZ-UUOKFMHZSA-N
DB04555
EXPT00868
Cytidine-5'-Diphosphate
63-38-7
1ZH821MXU5
null
ZWIADYZPOWUWEW-XVFCMESISA-N
DB04556
EXPT02841
NAP-226-90
139306-10-8
1608PLR9ZO
(-)-3-((1S)-1-(Dimethylamino)ethyl)phenol | 3-((1S)-1-(Dimethylamino)ethyl)phenol
GQZXRLWUYONVCP-QMMMGPOBSA-N
DB04557
EXPT00409
Arachidonic Acid
506-32-1
27YG812J1I
null
YZXBAPSDXZZRGB-DOFZRALJSA-N
DB04559
EXPT02578
N-(Chlorophenyl)-N'-hydroxyguanidine
130974-86-6
null
null
JYBXKTLYOMPMQY-UHFFFAOYSA-N
DB04560
EXPT01272
4,7-Dioxosebacic Acid
null
null
null
DUAWJQCMZICMIK-UHFFFAOYSA-N
DB04561
EXPT00595
4-acetamido-2,4-didexoy-D-glycero-beta-D-galacto-octopyranosylphosphonic acid
null
null
null
QITAGYVZDNZULE-HDBWYCHPSA-N
DB04562
EXPT03105
Tricarballylic acid
99-14-9
RA5QH2J020
1,2,3-propanetricarboxylic acid | 3-carboxyglutaric acid | 3-carboxypentanedioic acid | Carballylic acid | Carboxymethylsuccinic acid | β-carboxyglutaric acid
KQTIIICEAUMSDG-UHFFFAOYSA-N
DB04563
EXPT00276
CRA_9678
null
null
null
VIZNZQTZRMTYPZ-UHFFFAOYSA-M
DB04564
EXPT02023
Gluconolactone
90-80-2
WQ29KQ9POT
1,5-D-gluconolactone | 1,5-Gluconolactone | D-gluconic acid delta-lactone | D-glucono-1,5-lactone | D-threo-Aldono-1,5-lactone | delta-gluconolactone | GDL | Gluconic acid lactone | Glucono delta-lactone | Glucono-delta-lactone | Gluconolactone
PHOQVHQSTUBQQK-SQOUGZDYSA-N
DB04565
EXPT02962
4-(Acetylamino)-3-[(Hydroxyacetyl)Amino]Benzoic Acid
null
null
null
CRHJDPGLFDNPOA-UHFFFAOYSA-N
DB04566
EXPT01874
Inosinic Acid
131-99-7
TAO7US05G5
Cytosine inosinate
GRSZFWQUAKGDAV-KQYNXXCUSA-N
DB04567
EXPT01025
Chromophore (Gly-Tyr-Gly)
null
null
null
UZCDFHUXSDKGEZ-NGDPAIJVSA-N
DB04568
EXPT00477
5-Aminoimidazole Ribonucleoside
null
null
null
NKYAAYKKNSYIIW-XVFCMESISA-N
DB04569
EXPT02593
Benzyl formate
104-57-4
79GJF97O0Y
Phenylmethyl formate
UYWQUFXKFGHYNT-UHFFFAOYSA-N
DB04570
null
Latamoxef
64952-97-2
VUF6C936Z3
Festamoxin | Lamoxactam | Latamoxef | Latamoxefum | Moxalactam
JWCSIUVGFCSJCK-CAVRMKNVSA-N
DB04571
null
Trioxsalen
3902-71-4
Y6UY8OV51T
2',4,8-Trimethylpsoralen | 4,5',8-Trimethylpsoralen | 4,8,5'-Trimethylpsoralen | 6-hydroxy-β,2,7-trimethyl-5-benzofuranacrylic acid, δ-lactone | Trimethylpsoralen | Trioxisaleno | Trioxsalen | Trioxysalen | Trioxysalene | Trioxysalenum | Trisoralen
FMHHVULEAZTJMA-UHFFFAOYSA-N
DB04572
null
Thiotepa
52-24-4
905Z5W3GKH
Thiotepa
FOCVUCIESVLUNU-UHFFFAOYSA-N
DB04573
EXPT01361 | DB05375
Estriol
50-27-1
FB33469R8E
(16α,17β)-estra-1,3,5(10)-triene-3,16,17-triol | 1,3,5(10)-Estratriene-3,16-alpha,17beta-triol | 16-alpha-Hydroxyestradiol | 16alpha-hydroxyestradiol | 16α-hydroxyestradiol | 16α,17β-estriol | 3,16alpha,17beta-Trihydroxy-delta(1,3,5)-estratriene | Estriol | Oestriol | Östriol | Trihydroxyestrin
PROQIPRRNZUXQM-ZXXIGWHRSA-N
DB04574
null
Estrone sulfate
481-97-0
QTL48N278K
Estra-1,3,5 (10)-triene-17-one-3-yl-sulfate | Estrone 3-sulfate | Estrone bisulfate | Estrone hemisulfate | Estrone hydrogen sulfate | Estrone sulphate | Estrone-3-sulphate | Estrone, hydrogen sulfate
JKKFKPJIXZFSSB-CBZIJGRNSA-N
DB04575
null
Quinestrol
152-43-2
JR0N7XD5GZ
17-alpha-Ethinylestradiol 3-cyclopentyl ether | 17alpha-Ethynylestradiol 3-cyclopentyl ether | Estradiol-17-beta 3-cyclopentyl ether | Quinestrol | Quinestrolo | Quinestrolum
PWZUUYSISTUNDW-VAFBSOEGSA-N