Compound Search
化合物数据库
基于 PubChem CID 索引,支持名称 / 同义词 / CAS / SMILES 检索。
-
2-Naphthalenecarboxylic acid,4'-methylenebis[3-hydroxy-, compd. with 1-(4-chlorophenyl)-1,6-dihydro-6,6-dimethyl-1,3,5-triazine-2,4-diamine (1:2 with 4,6-diamino-1-(p-chlorophenyl)-1,2-dihydro-2,2-dimethyl-s-triazine (1:2) CAS 609-78-9 PubChem CID 11870
CC1(C)N=C(N)N=C(N)N1c1ccc(Cl)cc1.O=C(O)c1cc2ccccc2c(Cc2c(O)c(C(=O)O)cc3ccccc23)c1O -
2,6-Epoxy-2H-naphthaceno[1,2-b]oxocin-14-carboxylic acid, 4-(dimethylamino)-3,4,5,6,9,11,12,13,14,16-decahydro-3,5,8,10,11,13-hexahydroxy-6,13-dimethyl-9,16-dioxo-, methyl ester, (2.alpha.,3.beta.,4.alpha.,5.beta.,6.alpha.,11.beta.,13.alpha.,14.alpha.)- CAS 11052-70-3 PubChem CID 122727
COC(=O)C1c2cc3c(c(O)c2C(O)CC1(C)O)C(=O)c1c(O)cc2c(c1C3=O)OC1OC2(C)C(O)C(N(C)C)C1O -
ethyl ((8S,9S,10R,11S,13S,14S,17R)-11-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl) carbonate CAS 104286-02-4 PubChem CID 128526
CCOC(=O)O[C@]1(C(=O)CO)CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C -
COc1cccc2nc3n(c(=O)c12)CCC3 -
[(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-3-hydroxy-10,13-dimethyl-2,16-bis(1-methylpiperidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate;dibromide CAS 41261-71-6 PubChem CID 218732
CC(=O)O[C@H]1[C@@H]([N+]2(C)CCCCC2)C[C@H]2[C@@H]3CC[C@H]4C[C@H](O)[C@@H]([N+]5(C)CCCCC5)C[C@]4(C)[C@H]3CC[C@@]21C.[Br-].[Br-] -
C=C1C(=O)OCC1O -
N-[3-[6- (tetrahydro- pyran-4- ylamino) imidazo[1,2- b]pyridazin- 3-yl]phenyl] acetamide CAS 928335-98-2 PubChem CID 6419813
CC(=O)Nc1cccc(-c2cnc3ccc(NC4CCOCC4)nn23)c1 -
5-(3-hydroxy-propyl)-7-methoxy-2-(3''-methoxy-4''-hydroxy-phenyl)-3-benzo[b]furanecarbaldehyde PubChem CID 6709746
COc1cc(-c2oc3c(OC)cc(CCCO)cc3c2C=O)ccc1O -
(2S)-5-Hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylic acid--10-[2-(dimethylamino)ethyl]-5-methyl-5,10-dihydro-11H-dibenzo[b,e][1,4]diazepin-11-one (1/1) CAS 93963-57-6 PubChem CID 44151887
CN(C)CCN1C(=O)c2ccccc2N(C)c2ccccc21.O=C1CC[C@@H](C(=O)O)N1 -
1-PIPERIDINECARBOXAMIDE, N-((3R,6S)-6-(2,3-DIFLUOROPHENYL)HEXAHYDRO-2-OXO-1-(2,2,2- TRIFLUOROETHYL)-1H-AZEPIN-3-YL)-4-(2,3-DIHYDRO-2-OXO-1H-IMIDAZO(4,5-B)PYRIDIN-1-YL)-, COMPD. WITH ETHANOL, POTASSIUM SALT (1:1:1) CAS 953077-35-5 PubChem CID 46174140
CCO.O=C(N[C@@H]1CC[C@@H](c2cccc(F)c2F)CN(CC(F)(F)F)C1=O)N1CCC(n2c(=O)[n-]c3ncccc32)CC1.[K+] -
5-[(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}-2-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione CAS 1065478-14-9 PubChem CID 46216676
Cc1cc(Oc2ncc(C(F)(F)F)cc2Cl)ccc1CC1SC(=O)NC1=O -
[4-[1-[[5-Chloro-2-(trifluoromethyl)phenyl]methyl]-1,2,3,4-tetrahydropyrido[2,3-b]pyrazin-7-yl]phenyl][4-(1-pyrrolidinyl)-1-piperidinyl]methanone CAS 957194-90-0 PubChem CID 46871638
O=C(c1ccc(-c2cnc3c(c2)N(Cc2cc(Cl)ccc2C(F)(F)F)CCN3)cc1)N1CCC(N2CCCC2)CC1 -
(2S)-5-Hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylic acid--(4aS,9aS)-2,4a,9-trimethyl-2,3,4,4a,9,9a-hexahydro[1,2]oxazino[6,5-b]indol-6-yl hydrogen methylcarbonimidate (1/1) CAS 93803-77-1 PubChem CID 56843313
CNC(=O)Oc1ccc2c(c1)[C@]1(C)CCN(C)O[C@@H]1N2C.O=C1CC[C@@H](C(=O)O)N1 -
O=[N+]([O-])c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1.c1ccc2sccc2c1 -
Ethyl (1R,2R,3S,4R,5S)-4-acetamido-5-amino-2-azido-3-(pentan-3-yloxy)cyclohexane-1-carboxylate (Oseltamivir Impurity pound(c) CAS 2125702-80-7 PubChem CID 76968516
CCOC(=O)[C@@H]1C[C@H](N)[C@@H](NC(C)=O)[C@H](OC(CC)CC)[C@@H]1N=[N+]=[N-] -
3-{[(3R)-4-(difluoromethyl)-2,2-difluoro-3-hydroxy-1,1-dioxo-2,3-dihydro-1H-1-benzothiophen-5-yl]oxy}-5-fluorobenzonitrile CAS 1799948-06-3 PubChem CID 91810395
N#Cc1cc(F)cc(Oc2ccc3c(c2C(F)F)[C@@H](O)C(F)(F)S3(=O)=O)c1 -
2,4-Pyrimidinediamine, N4-methyl-N2-[2-methyl-1-[2-[(3-methyl-3H-imidazo[4,5-b]pyridin-6-yl)oxy]phenyl]-1H-indol-6-yl]- CAS 1940206-71-2 PubChem CID 121231410
CNc1ccnc(Nc2ccc3cc(C)n(-c4ccccc4Oc4cnc5c(c4)ncn5C)c3c2)n1 -
Benzamide, N-(((2,5-dichloro-4-hydroxyphenyl)amino)carbonyl)-2,6-difluoro- CAS 2767988-84-9 PubChem CID 122201314
O=C(NC(=O)c1c(F)cccc1F)Nc1cc(Cl)c(O)cc1Cl -
[2-[[(5R)-6,7-dihydro-5H-cyclopenta[b]pyridin-5-yl]amino]pyrimidin-5-yl]-(8-oxa-2-azaspiro[4.5]decan-2-yl)methanone CAS 2765226-31-9 PubChem CID 167014213
O=C(c1cnc(N[C@@H]2CCc3ncccc32)nc1)N1CCC2(CCOCC2)C1 -
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)O)C(=O)C2