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CHEBI:86165 - (24S,25S)-cholest-5-en-3β,24,26-triol

ChEBI IDCHEBI:86165
ChEBI Name(24S,25S)-cholest-5-en-3β,24,26-triol
Stars
ASCII Name(24S,25S)-cholest-5-en-3beta,24,26-triol
DefinitionAn oxysterol that is cholesterol which is substituted by hydroxy groups at positions 24S and 27 and has S-configuration at position 25.
Last Modified14 June 2018
Submitternhn
DownloadsMolfile
FormulaC27H46O3
Net Charge0
Average Mass418.662
Monoisotopic Mass418.34470
SMILES[H][C@@]12CC=C3C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)CC[C@H](O)[C@@H](C)CO
InChIInChI=1S/C27H46O3/c1-17(5-10-25(30)18(2)16-28)22-8-9-23-21-7-6-19-15-20(29)11-13-26(19,3)24(21)12-14-27(22,23)4/h6,17-18,20-25,28-30H,5,7-16H2,1-4H3/t17-,18+,20+,21+,22-,23+,24+,25+,26+,27-/m1/s1
InChIKeyXMULUVSUDUCTFU-QDKHZERXSA-N
Roles Classification
Biological Role:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
ChEBI Ontology
Outgoing Relation(s)
(24S,25S)-cholest-5-en-3β,24,26-triol (CHEBI:86165) has role human xenobiotic metabolite (CHEBI:76967)
(24S,25S)-cholest-5-en-3β,24,26-triol (CHEBI:86165) is a 24-hydroxy steroid (CHEBI:36865)
(24S,25S)-cholest-5-en-3β,24,26-triol (CHEBI:86165) is a 26-hydroxy steroid (CHEBI:36852)
(24S,25S)-cholest-5-en-3β,24,26-triol (CHEBI:86165) is a 3β-hydroxy-Δ5-steroid (CHEBI:1722)
(24S,25S)-cholest-5-en-3β,24,26-triol (CHEBI:86165) is a 3β-sterol (CHEBI:35348)
(24S,25S)-cholest-5-en-3β,24,26-triol (CHEBI:86165) is a cholestanoid (CHEBI:50401)
(24S,25S)-cholest-5-en-3β,24,26-triol (CHEBI:86165) is a oxysterol (CHEBI:53030)
IUPAC Name 
(3β,24S,25S)-cholest-5-ene-3,24,26-triol
Synonyms  Source
24S,25S-24,26-dihydroxycholesterolSUBMITTER
(25S)-cholest-5-ene-3β,24S,26-triolChEBI
UniProt Name  Source
(24S,25R)-24,26-dihydroxycholesterolUniProt
Citations