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CHEBI:137063 - cholestanol 7α,8α-epoxide

ChEBI IDCHEBI:137063
ChEBI Namecholestanol 7α,8α-epoxide
Stars
ASCII Namecholestanol 7alpha,8alpha-epoxide
DefinitionA cholestanoid that is lathosterol in which the double bond at position 7,8 has been oxidised to the corresponding epoxide (the 7α,8α stereoisomer).
Last Modified28 October 2019
Submitternhn
DownloadsMolfile
FormulaC27H46O2
Net Charge0
Average Mass402.663
Monoisotopic Mass402.34978
SMILES[H][C@]12C[C@@H](O)CC[C@]1(C)[C@@]1([H])CC[C@@]3(C)[C@@]([H])(CC[C@]3([H])[C@H](C)CCCC(C)C)[C@]13O[C@@H]3C2
InChIInChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-26(21,5)14-12-23-25(4)13-11-20(28)15-19(25)16-24-27(22,23)29-24/h17-24,28H,6-16H2,1-5H3/t18-,19-,20+,21-,22-,23-,24-,25+,26-,27+/m1/s1
InChIKeyJUEGMZBKIWIYAP-JGSBZTSISA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (21813643)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
cholestanol 7α,8α-epoxide (CHEBI:137063) has functional parent 5α-cholest-7-en-3β-ol (CHEBI:17168)
cholestanol 7α,8α-epoxide (CHEBI:137063) has role human metabolite (CHEBI:77746)
cholestanol 7α,8α-epoxide (CHEBI:137063) is a 3β-hydroxy steroid (CHEBI:36836)
cholestanol 7α,8α-epoxide (CHEBI:137063) is a cholestanoid (CHEBI:50401)
cholestanol 7α,8α-epoxide (CHEBI:137063) is a epoxy steroid (CHEBI:145217)
IUPAC Name 
7α,8α-epoxy-5α-cholestan-3α-ol
Synonyms  Source
7α,8α-epoxy-cholestanolSUBMITTER
(3β,5α,7α,8α)-7,8-epoxycholestan-3-olIUPAC
UniProt Name  Source
7α,8α-epoxy-5α-cholestan-3β-olUniProt
Registry NumbersSources
Reaxys:5964874Reaxys
Citations