cholesteryl sulfate
Molecular Formula:
C27H46O4S
InChI: InChI=1/C27H46O4S/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(31-32(28,29)30)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25H,6-8,10-17H2,1-5H3,(H,28,29,30)/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1/f/h28H
InChIKey: InChIKey=BHYOQNUELFTYRT-VIDFPMMIDM
SMILES: [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OS(O)(=O)=O)[C@H](C)CCCC(C)C
CAS number 1256-86-6
Names:
CHEBI:35377
Cholesterol sulfate
cholesterol sulfate
Cholesteryl sulfate
cholesteryl sulfate
cholest-5-en-3beta-yl hydrogen sulfate
CHOLEST-5-EN-3-YL HYDROGEN SULFATE
(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-3-sulfooxy-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
1256-86-6
Registries:
PubChem CID 65076
Beilstein =3225885
CAS 1256-86-6 (from NIST)
ChEBI 35377
chemPDB C3S
PubChem ID 11533690
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