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CHEBI:87053 - 4α-hydroxymethyl-5α-cholest-8-en-3β-ol

ChEBI IDCHEBI:87053
ChEBI Name4α-hydroxymethyl-5α-cholest-8-en-3β-ol
Stars
ASCII Name4alpha-hydroxymethyl-5alpha-cholest-8-en-3beta-ol
DefinitionA 3β-sterol that is 5α-cholest-8-en-3β-ol carrying an additional hydroxymethyl substituent at position 4α.
Last Modified2 November 2015
Submitterabridge
DownloadsMolfile
FormulaC28H48O2
Net Charge0
Average Mass416.690
Monoisotopic Mass416.36543
SMILES[H][C@@]12CC[C@]([H])([C@H](C)CCCC(C)C)[C@@]1(C)CCC1=C2CC[C@@]2([H])[C@H](CO)[C@@H](O)CC[C@]12C
InChIInChI=1S/C28H48O2/c1-18(2)7-6-8-19(3)22-11-12-23-20-9-10-24-21(17-29)26(30)14-16-28(24,5)25(20)13-15-27(22,23)4/h18-19,21-24,26,29-30H,6-17H2,1-5H3/t19-,21+,22-,23+,24+,26+,27-,28+/m1/s1
InChIKeyUPEGTKGKNWDIAN-NUESBDPTSA-N
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
4α-hydroxymethyl-5α-cholest-8-en-3β-ol (CHEBI:87053) has role human metabolite (CHEBI:77746)
4α-hydroxymethyl-5α-cholest-8-en-3β-ol (CHEBI:87053) is a 3β-sterol (CHEBI:35348)
4α-hydroxymethyl-5α-cholest-8-en-3β-ol (CHEBI:87053) is a cholestanoid (CHEBI:50401)
IUPAC Names 
4α-(hydroxymethyl)-5α-cholest-8-en-3β-ol
(3β,4α,5α)-4-(hydroxymethyl)cholest-8-en-3-ol
Synonym  Source
4alpha-hydroxymethyl-5alpha-cholest-8-en-3beta-olHMDB
UniProt Name  Source
4α-hydroxymethyl-5α-cholest-8-en-3β-olUniProt
Manual XrefsDatabases
LMST01010235LIPID MAPS
HMDB0012173HMDB
CPD-8617MetaCyc