Ergostane
(8R,9S,10S,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
Also Known As: Ergostane|5xi-Ergostane||A,|A,|A-(20R,24S)-24-methylcholestane|(8R,9S,10S,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene|(3S,6R)-6-[(1R,3aS,3bR,9aS,9bS,11aR)-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-2,3-dimethylheptane|(8R,9S,10S,13R,14S,17R)-17-((2R,5S)-5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta(a)phenanthrene
| Molecular Formula | C28H50 |
|---|---|
| Molecular Weight | 386.39127 g/mol |
| LogP | 8.7438 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.39127 |
| Monoisotopic Mass | 386.39127 |
| Heavy Atoms | 28 |
| Complexity | 534.1564 |
Chemical Identifiers
| CAS Number | 25318-39-2 |
|---|---|
| SMILES | C[C@H](CC[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4[C@@]3(CCCC4)C)C |
Product Overview
Ergostane (CAS 25318-39-2), with molecular formula C28H50 and molecular weight 386.39127 g/mol. IUPAC: (8R,9S,10S,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene.
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