CHEBI:136579 - cholesterol sulfate(1−)

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ChEBI Name cholesterol sulfate(1−)
ChEBI ID CHEBI:136579
ChEBI ASCII Name cholesterol sulfate(1-)
Definition A steroid sulfate oxoanion obtained by deprotonation of the sulfo group of cholesterol sulfate; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information
Download Molfile XML SDF
Formula C27H45O4S
Net Charge -1
Average Mass 465.711
Monoisotopic Mass 465.30440
InChI InChI=1S/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)/p-1/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1
InChIKey BHYOQNUELFTYRT-DPAQBDIFSA-M
SMILES O(S([O-])(=O)=O)[C@@H]1CC=2[C@]([C@]3(CC[C@]4([C@]([C@@]3(CC2)[H])(CC[C@@]4([C@H](C)CCCC(C)C)[H])[H])C)[H])(C)CC1
ChEBI Ontology
Outgoing cholesterol sulfate(1−) (CHEBI:136579) is a steroid sulfate oxoanion (CHEBI:59696)
cholesterol sulfate(1−) (CHEBI:136579) is conjugate base of cholesterol sulfate (CHEBI:41321)
Incoming cholesterol sulfate (CHEBI:41321) is conjugate acid of cholesterol sulfate(1−) (CHEBI:136579)
IUPAC Name
cholest-5-en-3β-yl sulfate
Synonyms Sources
(3β)-cholest-5-en-3-yl sulfate IUPAC
cholesterol sulfate UniProt
Citation Waiting for Citations Type Source
12145317 PubMed citation SUBMITTER
Last Modified
16 June 2017