Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L2SZ4K
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| Ligand Name |
[(3r,5r,6s)-1-[(2s)-1-Tert-Butoxy-1-Oxobutan-2-Yl]-5-(3-Chlorophenyl)-6-(4-Chlorophenyl)-2-Oxopiperidin-3-Yl]acetic Acid
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| Synonyms |
CHEMBL2177187; [(3r,5r,6s)-1-[(2s)-1-Tert-Butoxy-1-Oxobutan-2-Yl]-5-(3-Chlorophenyl)-6-(4-Chlorophenyl)-2-Oxopiperidin-3-Yl]acetic Acid; SCHEMBL9990677; BDBM50397776; Q27451340; 0R2; 2-((3R,5R,6S)-1-((S)-1-tert-Butoxy-1-oxobutan-2-yl)-5-(3-chlorophenyl)-6-(4-chlorophenyl)-2-oxopiperidin-3-yl)acetic acid
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| Structure |
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Download2D MOL |
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| Formula |
C27H31Cl2NO5
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| Canonical SMILES |
CCC(C(=O)OC(C)(C)C)N1C(C(CC(C1=O)CC(=O)O)C2=CC(=CC=C2)Cl)C3=CC=C(C=C3)Cl
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| InChI |
1S/C27H31Cl2NO5/c1-5-22(26(34)35-27(2,3)4)30-24(16-9-11-19(28)12-10-16)21(17-7-6-8-20(29)13-17)14-18(25(30)33)15-23(31)32/h6-13,18,21-22,24H,5,14-15H2,1-4H3,(H,31,32)/t18-,21-,22+,24-/m1/s1
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| InChIKey |
ZEMLYWMOSZRCQL-UWSZBUKDSA-N
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| PubChem Compound ID | ||||
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