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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O=C([O-])C(O)C(O)C(O)C(=O)[O-].[Ca+2] -
(3s)-4-(benzyloxy)-3-(formylamino)-4-oxobutanoic acid(non-preferred name) CAS 56816-63-8 PubChem CID 111071
O=CN[C@@H](CC(=O)O)C(=O)OCc1ccccc1 -
-ethyl-3-methoxy-6,7,11,12,13,14,15,16-octahydro-17h-cyclopenta[a]phenanthren-17-one(non-preferred name CAS 5941-92-4 PubChem CID 111113
CC[C@]12CCC3=C(CCc4cc(OC)ccc43)[C@@H]1CCC2=O -
13-ethyl-3-methoxy-7,11,12,13,14,15,16,17-octahydro-6h-cyclopenta[a]phenanthren-17-ol(non-preferred name CAS 7443-72-3 PubChem CID 111300
CC[C@]12CCC3=C(CCc4cc(OC)ccc43)[C@@H]1CC[C@@H]2O -
dihydropyrimidin-1(2h)-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl hydrogen phosphate(non-preferred name CAS 10061-10-6 PubChem CID 112074
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](OP(=O)(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)[C@H]1O -
4-[(e)-(2-chloro-4-nitrophenyl)diazenyl]-3-(propanoylamino)phenyl}imino)dipropanoate(non-preferred name CAS 97890-01-2 PubChem CID 113457
CCC(=O)Nc1cc(N(CCC(=O)OC)CCC(=O)OC)ccc1N=Nc1ccc([N+](=O)[O-])cc1Cl -
2-[(carbamoyloxy)methyl]-2-ethyl-3-methylhexyl carbamate(non-preferred name) CAS 63834-86-6 PubChem CID 113947
CCCC(C)C(CC)(COC(N)=O)COC(N)=O -
2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl]propanoic acid(non-preferred name CAS 63815-34-9 PubChem CID 114243
C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@@]2(O)CCC(=O)O -
2-{[(dimethylcarbamoyl)oxy]methyl}-2-ethylbutyl dimethylcarbamate(non-preferred name) CAS 63834-75-3 PubChem CID 114342
CCC(CC)(COC(=O)N(C)C)COC(=O)N(C)C -
hexamethyl-2,10-dioxooxacyclotetradecan-6-yl]oxy}-6-methyltetrahydro-2h-pyran-3-yl acetate(non-preferred name CAS 992-69-8 PubChem CID 114919
CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2OC(C)=O)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O -
-[(2-aminonaphthalen-1-yl)oxy]-2,4,5-trihydroxytetrahydro-2h-pyran-2-carboxylic acid(non-preferred name CAS 63976-07-8 PubChem CID 115432
Nc1ccc2ccccc2c1OC1OC(O)(C(=O)O)CC(O)C1O -
(4S)-4-Amino-5-[(2-methyl-2-propanyl)oxy]-5-oxopentanoic acid (non-preferred name) CAS 45120-30-7 PubChem CID 117505
CC(C)(C)OC(=O)[C@@H](N)CCC(=O)O -
2-[(carbamoyloxy)methyl]-2-[(diethylamino)methyl]butyl carbamate(non-preferred name) CAS 25480-68-6 PubChem CID 117525
CCN(CC)CC(CC)(COC(N)=O)COC(N)=O -
2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl]butanoic acid(non-preferred name CAS 34751-25-2 PubChem CID 118184
CC(=O)O[C@@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC[C@H]([C@H](C)CC(=O)O)[C@@]4(C)CC[C@@H]32)C1 -
-17-azoniapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene diiodide(non-preferred name CAS 152-81-8 PubChem CID 120646
C[N+](C)(C)CCC[N+]1(C)CC2C3c4ccccc4C(c4ccccc43)C2C1.[I-].[I-] -
2-amino-3-{[(2-amino-2-carboxyethyl)sulfanyl]sulfonyl}propanoic acid(non-preferred name) CAS 30452-69-8 PubChem CID 121714
NC(CSS(=O)(=O)CC(N)C(=O)O)C(=O)O -
,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl dihydrogen diphosphate (non-preferred name CAS 2147-59-3 PubChem CID 121966
Cc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)O2)c(=O)[nH]c1=O -
(2s,5s)-2-amino-6-[(5-amino-5-carboxypentyl)amino]-5-hydroxyhexanoic acid(non-preferred name) CAS 21895-67-0 PubChem CID 122155
NC(CCCCNC[C@@H](O)CC[C@H](N)C(=O)O)C(=O)O -
dioxo-2,4,6-trioxa-11,15-diaza-3|E5,5|E5-diphosphaheptadecan-17-yl} benzenecarbothioate(non-preferred name CAS 6756-74-7 PubChem CID 122174
CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)c1ccccc1 -
)-5-(6-amino-9h-purin-9-yl)-n-cyclopropyl-3,4-dihydroxytetrahydrofuran-2-carboxamide(non-preferred name CAS 50908-62-8 PubChem CID 122257
Nc1ncnc2c1ncn2C1O[C@H](C(=O)NC2CC2)[C@@H](O)[C@H]1O