EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:37640 - (24S)-7α,24-dihydroxycholesterol

ChEBI IDCHEBI:37640
ChEBI Name(24S)-7α,24-dihydroxycholesterol
Stars
ASCII Name(24S)-7alpha,24-dihydroxycholesterol
DefinitionA 7α,24-dihydroxycholesterol in which has S configuration at position 24.
Last Modified25 April 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC27H46O3
Net Charge0
Average Mass418.662
Monoisotopic Mass418.34470
SMILES[H][C@]12CC[C@@]3(C)[C@@]([H])(CC[C@]3([H])[C@H](C)CC[C@H](O)C(C)C)[C@]1([H])[C@H](O)C=C1C[C@@H](O)CC[C@@]12C
InChIInChI=1S/C27H46O3/c1-16(2)23(29)9-6-17(3)20-7-8-21-25-22(11-13-27(20,21)5)26(4)12-10-19(28)14-18(26)15-24(25)30/h15-17,19-25,28-30H,6-14H2,1-5H3/t17-,19+,20-,21+,22+,23+,24-,25+,26+,27-/m1/s1
InChIKeyZNCHPOYZMVVJCK-LIZWOPGQSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
(24S)-7α,24-dihydroxycholesterol (CHEBI:37640) has role human metabolite (CHEBI:77746)
(24S)-7α,24-dihydroxycholesterol (CHEBI:37640) is a 7α,24-dihydroxycholesterol (CHEBI:50517)
IUPAC Name 
(24S)-cholest-5-ene-3β,7α,24-triol
Synonyms  Source
(24S)-Cholest-5-ene-3beta,7alpha,24-triolKEGG COMPOUND
5-Cholesten-3beta,7alpha,24(S)-triolKEGG COMPOUND
UniProt Name  Source
(24S)-7α-dihydroxycholesterolUniProt
Manual XrefsDatabases
C15518KEGG COMPOUND
Registry NumbersSources
Beilstein:9023517Beilstein