3-Acetoxy-24-nor-3beta-chol-5-en-23-oic acid
(3R)-3-[(3R,8S,9S,10R,13R,14S,17R)-3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]butanoic acid
Also Known As: EINECS 252-185-4|KST-1A4180|3-Acetoxy-24-nor-3beta-chol-5-en-23-oic acid|A-Acetoxy-24-nor-chol-5-en-23-saeure|A-acetoxy-24-nor-chol-5-en-23-oic acid|24-Norchol-5-en-23-oic acid, 3-(acetyloxy)-, (3.beta.)-|(3r)-3-[(3r,8s,9s,10r,13r,14s,17r)-3-(acetyloxy)-10,13-dimethyl-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)|(3R)-3-[(3R,8S,9S,10R,13R,14S,17R)-3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]butanoic acid
| Molecular Formula | C25H38O4 |
|---|---|
| Molecular Weight | 402.277 g/mol |
| LogP | 5.61 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.277 |
| Heavy Atoms | 29 |
| Complexity | 711.6 |
Chemical Identifiers
| CAS Number | 34751-25-2 |
|---|---|
| SMILES | C[C@H](CC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@H](C4)OC(=O)C)C)C |
Product Overview
3-Acetoxy-24-nor-3beta-chol-5-en-23-oic acid (CAS 34751-25-2), with molecular formula C25H38O4 and molecular weight 402.277 g/mol. IUPAC: (3R)-3-[(3R,8S,9S,10R,13R,14S,17R)-3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]butanoic acid.
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