Compound Search
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基于 PubChem CID 索引，支持名称 / 同义词 / CAS / SMILES 检索。
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C=C1CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O[C@@H]7O[C@@H](C)[C@H](O)[C@@H](O)[C@H]7O)[C@H]6O)[C@@](C)(CO)C5CC[C@]43C)[C@@H]2C1 -
(2S,3S,4S,5R,6R)-6-[[(2R,3S,4S,6Ar,6bS,8aS,12aS,14bR)-4-carboxy-2-hydroxy-4,6a,6b,14b-tetramethyl-11-methylidene-8a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid CAS 214840-34-3 PubChem CID 146116246
C=C1CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CCC4[C@@]5(C)C[C@@H](O)[C@@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(C(=O)O)C5CC[C@]43C)[C@@H]2C1 -
C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@@H]3[C@H](O)C[C@@]4(C)C(CC[C@]5(C)C4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]45C)[C@]3(C)CO)O[C@H](C(=O)O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O -
(2S)-4-[(3R)-3-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl]pyrrolidin-1-yl]-2-[[2-(trifluoromethyl)benzoyl]amino]butanoic acid PubChem CID 146209205
O=C(N[C@@H](CCN1CC[C@@H](CCc2ccc3c(n2)NCCC3)C1)C(=O)O)c1ccccc1C(F)(F)F -
tert-butyl (S)-2-(4-(4-(3- (hydroxyamino)prop-1-yn-1- yl)phenyl)-2,3,9-trimethyl-6H- thieno[3,2-f][1,2,4]triazolo[4,3-a] [1,4]diazepin-6-yl)acetate PubChem CID 146450780
Cc1sc2c(c1C)C(c1ccc(C#CCNO)cc1)=N[C@@H](CC(=O)OC(C)(C)C)c1nnc(C)n1-2 -
(1-(3-((4a,8a- dihydroisoquinolin- 6-yl)thio)-1H- pyrazolo[3,4- b]pyrazin-6-yl)-4- methylpiperidin-4- yl)methanamine PubChem CID 146592519
CC1(CN)CCN(c2cnc3c(SC4=CC5C=CN=CC5C=C4)n[nH]c3n2)CC1 -
[(3aR,6aS)-5-[2-(trifluoromethyl)phenyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-(1H-pyrrolo[2,3-c]pyridin-3-yl)methanone PubChem CID 147746844
O=C(c1c[nH]c2cnccc12)N1C[C@H]2CC(c3ccccc3C(F)(F)F)C[C@H]2C1 -
C[C@@H]1CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)C(C)(C)C5CC[C@]43C)[C@@H]2[C@]1(C)O -
8a,9-dihydroxy-7-[1-hydroxy-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-1,4a,7-trimethyl-2,3,4,4b,5,6,8,9,10,10a-decahydrophenanthrene-1-carboxylic acid PubChem CID 154814086
CC1(C(O)COC2OC(CO)C(O)C(O)C2O)CCC2C3(C)CCCC(C)(C(=O)O)C3CC(O)C2(O)C1 -
COc1cc(-c2cn(C)c(=O)c3cnccc23)cc(OC)c1CN1CC2(CC(C(=O)NCCCCCCNc3cccc4c3C(=O)N(C3CCC(=O)NC3=O)C4=O)C2)C1 -
COc1cc(-c2cn(C)c(=O)c3cnccc23)cc(OC)c1CN1CC2(CC(C(=O)NCCCCCCCCNc3cccc4c3C(=O)N(C3CCC(=O)NC3=O)C4=O)C2)C1 -
(2R,2aS,4R,5S,5'S,6aR,8aS,9S)-5',6a,8a,9-tetramethyldocosahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-10,2'-pyran]-2,4,5-triol PubChem CID 163355674
C[C@H]1CCC2(OC1)OC1CC3C4C[C@@H](O)[C@H]5C[C@@H](O)[C@@H](O)C[C@]5(C)C4CC[C@]3(C)C1[C@@H]2C -
2-oxo-1''-(4-(trifluoromethyl)benzoyl)spiro[indoline-3,4''-piperidine]-5-carboxylic acid PubChem CID 163399320
O=C(O)c1ccc2c(c1)C1(CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC1)C(=O)N2 -
N-((S)-1-(2-((R)-2-Chloro-2-fluoroacetyl)-2-(((S)-2-oxopyrrolidin-3-yl)methyl)hydrazineyl)-4-methyl-1-oxopentan-2-yl)-4-fluoro-1H-indole-2-carboxamide CAS 2913186-57-7 PubChem CID 165437861
CC(C)C[C@H](NC(=O)c1cc2c(F)cccc2[nH]1)C(=O)NN(C[C@@H]1CCNC1=O)C(=O)[C@H](F)Cl -
6-(cyclohexylmethoxy)-1,2,3,4-tetrahydrophthalazine-1,4-dione CAS 2892064-88-7 PubChem CID 166597670
O=c1[nH][nH]c(=O)c2cc(OCC3CCCCC3)ccc12 -
C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1C[C@H]1O[C@@H](c3ccc(Cc4cc(N)c5c(c4)CCO5)cc3)O[C@]12C(=O)CO -
C[C@]12C=CC(=O)C=C1[C@@H](F)C[C@H]1[C@@H]3C[C@H]4O[C@@H](c5ccc(Cc6ccc7c(c6)OCCN7)cc5)O[C@@]4(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F -
C[C@]12C=CC(=O)C=C1[C@@H](F)C[C@H]1[C@@H]3C[C@H]4O[C@@H](c5ccc(Cc6ccc(N)c7c6CCO7)cc5)O[C@@]4(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@]12F -
C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1C[C@H]1O[C@@H](c3ccc(Cc4ccc5cc[nH]c5c4)cc3)O[C@]12C(=O)CO -
C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1C[C@H]1O[C@@H](c3ccc(Cc4ccc(N)c5ncoc45)cc3)O[C@]12C(=O)CO