Cholesterol sulfate
[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate
| Molecular Formula | C27H46O4S |
|---|---|
| Molecular Weight | 466.7 g/mol |
| LogP | 8.2 |
| Topological Polar Surface Area | 72.0 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 466.31168 |
| Heavy Atoms | 32 |
| Complexity | 812.0 |
Chemical Identifiers
| CAS Number | 1256-86-6 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OS(=O)(=O)O)C)C |
| InChIKey | BHYOQNUELFTYRT-DPAQBDIFSA-N |
📖 Product Overview
Cholesterol sulfate (CAS: 1256-86-6) is a chemical compound with molecular formula C27H46O4S and molecular weight 466.7 g/mol. Its IUPAC systematic name is [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate.
BHYOQNUELFTYRT-DPAQBDIFSA-N.
SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OS(=O)(=O)O)C)C.
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