CHEBI:136567 - (24S)-hydroxycholesterol 3-sulfate(1−)

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ChEBI Name (24S)-hydroxycholesterol 3-sulfate(1−)
ChEBI ID CHEBI:136567
ChEBI ASCII Name (24S)-hydroxycholesterol 3-sulfate(1-)
Definition A steroid sulfate oxoanion obtained by deprotonation of the sulfo group of (24S)-hydroxycholesterol 3-sulfate.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information
Download Molfile XML SDF
Formula C27H45O5S
Net Charge -1
Average Mass 481.710
Monoisotopic Mass 481.29932
InChI InChI=1S/C27H46O5S/c1-17(2)25(28)11-6-18(3)22-9-10-23-21-8-7-19-16-20(32-33(29,30)31)12-14-26(19,4)24(21)13-15-27(22,23)5/h7,17-18,20-25,28H,6,8-16H2,1-5H3,(H,29,30,31)/p-1/t18-,20+,21+,22-,23+,24+,25+,26+,27-/m1/s1
InChIKey UZRYBCGKNZOEMQ-XWXSNNQWSA-M
SMILES [C@@]12([C@]3([C@](CC[C@@]1([C@@]4(C(C[C@H](CC4)OS([O-])(=O)=O)=CC2)C)[H])([C@](CC3)([C@H](C)CC[C@@H](C(C)C)O)[H])C)[H])[H]
ChEBI Ontology
Outgoing (24S)-hydroxycholesterol 3-sulfate(1−) (CHEBI:136567) is a steroid sulfate oxoanion (CHEBI:59696)
(24S)-hydroxycholesterol 3-sulfate(1−) (CHEBI:136567) is conjugate base of (24S)-hydroxycholesterol 3-sulfate (CHEBI:137388)
Incoming (24S)-hydroxycholesterol 3-sulfate (CHEBI:137388) is conjugate acid of (24S)-hydroxycholesterol 3-sulfate(1−) (CHEBI:136567)
IUPAC Name
(3β,24S)-24-hydroxycholest-5-en-3-yl sulfate
Synonym Source
(24S)-hydroxycholesterol 3-sulfate UniProt
Citation Waiting for Citations Type Source
19589875 PubMed citation SUBMITTER
Last Modified
09 June 2017