(8S,9S,11S,13S,14S,17R)-17-ethynyl-11,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
(8S,9S,11S,13S,14S,17R)-17-ethynyl-11,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
| Molecular Formula | C21H26O2 |
|---|---|
| Molecular Weight | 310.4 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 40.5 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 310.19327 |
| Heavy Atoms | 23 |
| Complexity | 533.0 |
Chemical Identifiers
| CAS Number | 13655-95-3 |
|---|---|
| SMILES | CC1CC2(C(CCC2(C#C)O)C3C1C4=C(CC3)C=C(C=C4)O)C |
| InChIKey | KGJRLCXIOBYRKF-QDOXYTLXSA-N |
📖 Product Overview
(8S,9S,11S,13S,14S,17R)-17-ethynyl-11,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol (CAS: 13655-95-3) is a chemical compound with molecular formula C21H26O2 and molecular weight 310.4 g/mol. Its IUPAC systematic name is (8S,9S,11S,13S,14S,17R)-17-ethynyl-11,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol.
KGJRLCXIOBYRKF-QDOXYTLXSA-N.
SMILES: CC1CC2(C(CCC2(C#C)O)C3C1C4=C(CC3)C=C(C=C4)O)C.
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