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。
-
4-{5-[Bis(2-hydroxyethyl)amino]-1-methyl-1H-1,3-benzimidazol-2-yl}butanoic acid CAS 109882-30-6 PubChem CID 13755672
Cn1c(CCCC(=O)O)nc2cc(N(CCO)CCO)ccc21 -
14-(4-chlorophenyl)-6-oxa-11-thia-3,9,14,16-tetraazatetracyclo[8.7.0.0^{2,7}.0^{12,17}]heptadeca-1,7,9,12(17),15-pentaen-13-one PubChem CID 16659801
O=c1c2sc3ncc4c(c3c2ncn1-c1ccc(Cl)cc1)NCCO4 -
(5R)-14-(4-chlorophenyl)-5-methyl-6-oxa-11-thia-3,9,14,16-tetraazatetracyclo[8.7.0.0^{2,7}.0^{12,17}]heptadeca-1,7,9,12(17),15-pentaen-13-one PubChem CID 16659802
C[C@@H]1CNc2c(cnc3sc4c(=O)n(-c5ccc(Cl)cc5)cnc4c23)O1 -
(5S)-14-(4-chlorophenyl)-5-methyl-6-oxa-11-thia-3,9,14,16-tetraazatetracyclo[8.7.0.0^{2,7}.0^{12,17}]heptadeca-1,7,9,12(17),15-pentaen-13-one PubChem CID 16659803
C[C@H]1CNc2c(cnc3sc4c(=O)n(-c5ccc(Cl)cc5)cnc4c23)O1 -
14-(4-methoxyphenyl)-6-oxa-11-thia-3,9,14,16-tetraazatetracyclo[8.7.0.0^{2,7}.0^{12,17}]heptadeca-1,7,9,12(17),15-pentaen-13-one PubChem CID 16659967
COc1ccc(-n2cnc3c(sc4ncc5c(c43)NCCO5)c2=O)cc1 -
InChI=1/C19H12N2O8/c22-19(23)12-9-17(28-15-5-1-13(2-6-15)20(24)25)11-18(10-12)29-16-7-3-14(4-8-16)21(26)27/h1-11H,(H,22,23) CAS 173550-33-9 PubChem CID 16760376
O=C(O)c1cc(Oc2ccc([N+](=O)[O-])cc2)cc(Oc2ccc([N+](=O)[O-])cc2)c1 -
[Cr].[Cr].[Nb] -
(2S,3R,4S,5S,6R)-2-[(2S)-2-[(3S,5R,8R,9R,10R,12R,13R,14R,17S)-3,12-dihydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-en-2-yl]oxy-6-[[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol CAS 83480-65-3 PubChem CID 21672570
CC(C)=CCC[C@](C)(O[C@@H]1O[C@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@]12C -
1-Piperidinecarboxylic acid, 4-(8-chloro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-, ethyl ester; 11H-Benzo[5,6]cyclohepta[1,2-b]pyridine, 1-piperidinecarboxylic acid deriv.; Ethyl 4-(8-chloro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-1-piperidinecarboxylate CAS 133330-56-0 PubChem CID 22621944
CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3C=Cc3cccnc32)CC1 -
4H-Imidazol-4-one, 2-amino-1,5-dihydro-1-methyl-, compd. with zinc chloride (ZnCl2) (2:1) CAS 16045-72-0 PubChem CID 44134640
CN1CC(=O)N=C1N.CN1CC(=O)N=C1N.Cl[Zn]Cl -
N-[tert-Butoxy(hydroxy)methylidene]-L-alanine--N-cyclohexylcyclohexanamine (1/1) CAS 16948-17-7 PubChem CID 44146705
C1CCC(NC2CCCCC2)CC1.C[C@H](NC(=O)OC(C)(C)C)C(=O)O -
(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-methylbutanoic acid;piperidine CAS 84282-17-7 PubChem CID 44147618
C1CCNCC1.CC(C)[C@H](NS(=O)(=O)c1cccc2c(N(C)C)cccc12)C(=O)O -
Carbamic acid, [(1S)-1-formylpentyl]-, (1S)-1-methyl-2-phenylethyl ester CAS 736144-17-5 PubChem CID 44343301
CCCC[C@@H](C=O)NC(=O)O[C@@H](C)Cc1ccccc1 -
1-[(2R,5S,11S,14R,15R)-5-hydroxy-2,6,6,15-tetramethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-9-en-11-yl]ethan-1-one PubChem CID 44354270
CC(=O)[C@@]12CC[C@H]([C@H](C)CCCC(C)C)[C@@]1(C)CCC1C2=CCC2C(C)(C)[C@@H](O)CC[C@]12C -
COc1ccc2c(c1)OCCCC/C=C\CCCCN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CO[C@H]3OCC[C@H]31)S2(=O)=O -
COc1ccc2c(c1)OCC/C=C\CCCCN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CO[C@H]3OCC[C@H]31)S2(=O)=O -
1-(7-hydroperoxy-5-hydroxy-6-trioxidaneyl-24,33,44,54,64,74,83,94-pentaoxolo[5,4]hexaoxin-2-yl)-14,31-trioxidan-1-one compound with hydrogen peroxide (1:1) CAS 1010413-52-1 PubChem CID 45790733
COc1c(F)ccc(F)c1C#N -
US10479784, Compound I-104 PubChem CID 46834031
Nc1ncc(-c2cccnc2)nc1C(=O)Nc1ccc2[nH]ccc2c1 -
Acetic acid,[[4-[2-[6-[(carboxycarbonyl)amino]-2-methyl-4-pyrimidinyl]ethenyl]phenyl]amino]oxo-, (E)-, compd. with 2-aminoethanol (1:2)OTHER CA INDEX NAMES:Ethanol, 2-amino-,(E)-[[4-[2-[6-[(carboxycarbonyl)amino]-2-methyl-4-pyrimidinyl]ethenyl]phenyl]amino]oxoacetate (salt) (2:1) CAS 1016258-69-7 PubChem CID 46839935
CCOC(=O)C1(CN)CCN(C(=O)OC(C)(C)C)CC1 -
2-[(7S)-9-(4-chlorophenyl)-12-methoxy-3-methyl-2,4,5,8-tetraazatricyclo[8.4.0.0(2),?]tetradeca-1(10),3,5,8,11,13-hexaen-7-yl]-N-ethylacetamide CAS 1260907-17-2 PubChem CID 46943432
CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc21