AC1L5PBQ
(8S,9S,10R,13S,14S,17S)-17-(3-diethoxyphosphorylpropanoyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Also Known As: 1,3,5-trichloro-2-[(2,4,6-trichlorophenoxy)methoxymethoxy]be|(8S,9S,10R,13S,14S,17S)-17-(3-diethoxyphosphorylpropanoyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one|diethyl{3-[(8s,9s,10r,13s,14s,17s)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl]-3-oxopropyl}phosphonate(non-preferred name)
| Molecular Formula | C26H41O5P |
|---|---|
| Molecular Weight | 464.26917 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 464.26917 |
| Monoisotopic Mass | 464.26917 |
| Heavy Atoms | 32 |
| Complexity | 824.0 |
Chemical Identifiers
| CAS Number | 62268-75-1 |
|---|---|
| SMILES | CCOP(=O)(CCC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)OCC |
| InChIKey | GHXIZKWIGJMFAP-PDVSWFIFSA-N |
Product Overview
AC1L5PBQ (CAS 62268-75-1), with molecular formula C26H41O5P and molecular weight 464.26917 g/mol. IUPAC: (8S,9S,10R,13S,14S,17S)-17-(3-diethoxyphosphorylpropanoyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one.
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