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。
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CC(C)C(=O)Nc1ccc(S(N)(=O)=O)cc1 -
COc1ccccc1Oc1ccc(S(=O)(=O)NC(C)C(=O)O)cc1 -
1-[(2-chlorophenyl)methyl]-2-{1-[4-(2-methylpropyl)phenyl]ethyl}-1H-1,3-benzodiazole CAS 612046-20-5 PubChem CID 3610995
CC(C)Cc1ccc(C(C)c2nc3ccccc3n2Cc2ccccc2Cl)cc1 -
[2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate CAS 5740-62-5 PubChem CID 3796290
CCC(=O)OCC(=O)C1(O)CCC2C3CCC4=CC(=O)C=CC4(C)C3C(O)CC21C -
(11S)-11-benzyl-6-chloro-1,2,10,11,12,13,14,15,16,17,18,19-dodecahydro-5,9-methano-2,5,8,10,13,17-benzohexaazacyclohenicosine-3,24(4H)-dione PubChem CID 4369278
O=C1Cn2c(Cl)cnc(c2=O)N[C@@H](Cc2ccccc2)CNCCCNCCc2ccccc2CN1 -
1-(1,3-dimethyl-4-nitro-1H-pyrazol-5-yl)-3-(methylsulfanyl)-5-(thiophen-2-yl)-1H-pyrazole-4-carbonitrile PubChem CID 4398304
CSc1nn(-c2c([N+](=O)[O-])c(C)nn2C)c(-c2cccs2)c1C#N -
4-[(4-fluoro-3-morpholin-4-ylsulfonylbenzoyl)amino]benzoate PubChem CID 4424481
O=C([O-])c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)cc1 -
4,5,10,11-tetramethoxy-16-azapentacyclo[12.7.0.02,7.08,13.016,20]henicosa-1(14),2,4,6,8,10,12-heptaene CAS 25908-92-3 PubChem CID 5090648
COc1cc2c3c(c4cc(OC)c(OC)cc4c2cc1OC)CN1CCCC1C3 -
CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O.OC[C@H]1O[C@@H]2O[C@H]3[C@H](O)[C@@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O[C@H]6[C@H](O)[C@@H](O)[C@@H](O[C@H]7[C@H](O)[C@@H](O)[C@@H](O[C@H]1[C@H](O)[C@H]2O)O[C@@H]7CO)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO -
CNC[C@H](O)c1cccc(O)c1.Cl -
2-(4-HYDROXYPHENYL)-2-{[(2R,3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}ACETONITRILE CAS 499-20-7 PubChem CID 5318256
N#CC(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccc(O)cc1 -
(2S,3R,4S,5S,6R)-2-[4-[(3R,3aS,6R,6aS)-3-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol CAS 24404-49-7 PubChem CID 5351523
COc1cc(C2OCC3C(c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)ccc1O -
2-Propen-1-one, 3-(3,4-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)-, (2E)- CAS 76650-20-9 PubChem CID 5352007
COc1cc(OC)c(C(=O)/C=C/c2ccc(OC)c(OC)c2)c(OC)c1 -
7-hydroxy-4-methyl-8-(piperidin-1-ium-1-ylmethyl)chromen-2-one; pyridine-3-carboxylate CAS 10550-20-6 PubChem CID 5360359
Cc1cc(=O)oc2c(C[NH+]3CCCCC3)c(O)ccc12.O=C([O-])c1cccnc1 -
1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)decahydro-1,4a-dimethyl-6-methylene-, [1S-[1.alpha.,4a.alpha.,5.alpha.(E),8a.beta.]]- PubChem CID 5364174
C=C1CCC2C(C)(C(=O)O)CCCC2(C)C1CC/C(C)=C/C(=O)O -
CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O.O=C(O)/C=C\C(=O)O -
CCNC(=S)[S-].CC[NH3+] -
2-(2-Amino-4-thiazolyl)-2(Z)(methoxy)imino ethyl acetate; Ethyl (Z)-(2-Aminothiazol-4-yl)-a-methoxyiminoacetate; Ethyl (Z)-[2-Amino-4-thiazolyl](methoxyimino)acetate; Ethyl 2-(2-Aminothiazol-4-yl)-(Z)-2-(methoxyimino)acetate; CAS 64485-88-7 PubChem CID 5582977
CCOC(=O)/C(=N\OC)c1csc(N)n1 -
2-Butenoic acid, 2-methyl-, 1-(2,3-dihydro-7-oxo-7H-furo(3,2-g)(1)benzopyran-2-yl)-1-methylethyl ester, (E)-(+/-)- CAS 36706-20-4 PubChem CID 6183350
C/C=C(\C)C(=O)OC(C)(C)C1Cc2cc3ccc(=O)oc3cc2O1 -
(S)-6-amino-2-((S)-2-amino-5-guanidinopentanamido)hexanoic acid compound with acetic acid (1:1) CAS 40968-46-5 PubChem CID 6427006
NCCCC[C@H](NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)O