AC1LDO7K
methyl 4-(7,12-diacetyloxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanoate
Also Known As: 7,12-Diacetoxy-3-oxo-5-cholan-24-oic acid methyl ester|7|A,12|A-Diacetoxy-3-oxo-5|A-cholan-24-oic acid methyl ester|5.beta.-Cholan-24-oic acid, 7.alpha.,12.alpha.-dihydroxy-3-oxo-, methyl ester, diacetate|methyl 4-(7,12-diacetyloxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanoate
| Molecular Formula | C29H44O7 |
|---|---|
| Molecular Weight | 504.30872 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 96.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 504.30872 |
| Monoisotopic Mass | 504.30872 |
| Heavy Atoms | 36 |
| Complexity | 898.0 |
Chemical Identifiers
| CAS Number | 4947-65-3 |
|---|---|
| SMILES | CC(CCC(=O)OC)C1CCC2C1(C(CC3C2C(CC4C3(CCC(=O)C4)C)OC(=O)C)OC(=O)C)C |
| InChIKey | KTOYRTMQPLELSO-UHFFFAOYSA-N |
Product Overview
AC1LDO7K (CAS 4947-65-3), with molecular formula C29H44O7 and molecular weight 504.30872 g/mol. IUPAC: methyl 4-(7,12-diacetyloxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanoate.
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