AND076
(3S,10R,13S,17S)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one
Also Known As: AND076|3?,17?-Dihydroxy-5-androsten-7-one|4-Methyl-3-(trifluoromethyl)phenylaceticacid|Androst-5-en-7-one,3beta,17beta-dihydroxy|(8xi,9xi,14xi)-3beta,17beta-Dihydroxyandrost-5-en-7-one|Androst-5-en-7-one, 3,17-dihydroxy-, (3|A,17|A)-|(3S,10R,13S,17S)-3,17-Dihydroxy-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one
| Molecular Formula | C19H28O3 |
|---|---|
| Molecular Weight | 304.20386 g/mol |
| LogP | 2.85 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 304.20386 |
| Monoisotopic Mass | 304.20386 |
| Heavy Atoms | 22 |
| Complexity | 538.7984 |
Chemical Identifiers
| CAS Number | 2226-65-5 |
|---|---|
| SMILES | C[C@]12CCC3C(C1CC[C@@H]2O)C(=O)C=C4[C@@]3(CC[C@@H](C4)O)C |
Product Overview
AND076 (CAS 2226-65-5), with molecular formula C19H28O3 and molecular weight 304.20386 g/mol. IUPAC: (3S,10R,13S,17S)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-7-one.
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