Sodium cholesteryl sulfate structure

Sodium cholesteryl sulfate

sodium [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] sulfate

Also Known As: Sodium cholesteryl sulfate|Cholesteryl sodium sulfate|cholesteryl sulfate sodium|Cholesterol 3-sulfate sodium salt|Cholesterol, hydrogen sulfate, sodium salt|4CH-024697|Cholest-5-en-3-ol (3beta)-, hydrogen sulfate, sodium salt|Cholest-5-en-3-ol (3.beta.)-, hydrogen sulfate, sodium salt|5-Cholesten-3|A-ol sulfate sodium salt,Cholesterol 3-sulfate sodium salt,Cholesteryl sodium sulfate,Cholesteryl sulfate sodium salt|sodium [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] sulfate

CAS: 2864-50-8
Molecular Formula C27H45NaO4S
Molecular Weight 488.29364 g/mol
LogP 3.8772
Topological Polar Surface Area 66.43 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 7
Exact Mass 488.29364
Monoisotopic Mass 488.29364
Heavy Atoms 33
Complexity 823.97797

Chemical Identifiers

CAS Number 2864-50-8
SMILES CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OS(=O)(=O)[O-])C)C.[Na+]

Product Overview

Sodium cholesteryl sulfate (CAS 2864-50-8), with molecular formula C27H45NaO4S and molecular weight 488.29364 g/mol. IUPAC: sodium [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] sulfate.

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