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CHEBI:87289 - 4α-hydroxymethyl-4β-methylzymosterol

ChEBI IDCHEBI:87289
ChEBI Name4α-hydroxymethyl-4β-methylzymosterol
Stars
ASCII Name4alpha-hydroxymethyl-4beta-methylzymosterol
DefinitionA 3β-sterol that consists of 4β-methylzymosterol in which the 4α-hydrogen is replaced by a hydroxymethyl group.
Last Modified20 July 2021
Submitterlaimo
DownloadsMolfile
FormulaC29H48O2
Net Charge0
Average Mass428.701
Monoisotopic Mass428.36543
SMILES[H][C@@]12CCC3=C(CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@H](C)CCC=C(C)C)[C@@]1(C)CC[C@H](O)[C@@]2(C)CO
InChIInChI=1S/C29H48O2/c1-19(2)8-7-9-20(3)22-11-12-23-21-10-13-25-28(5,24(21)14-16-27(22,23)4)17-15-26(31)29(25,6)18-30/h8,20,22-23,25-26,30-31H,7,9-18H2,1-6H3/t20-,22-,23+,25-,26+,27-,28-,29+/m1/s1
InChIKeyLEUVIESGHNFBEK-WKYRUEGDSA-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-4β-methylzymosterol (CHEBI:87289) has functional parent zymosterol (CHEBI:18252)
4α-hydroxymethyl-4β-methylzymosterol (CHEBI:87289) has parent hydride lanostane (CHEBI:20265)
4α-hydroxymethyl-4β-methylzymosterol (CHEBI:87289) has role human metabolite (CHEBI:77746)
4α-hydroxymethyl-4β-methylzymosterol (CHEBI:87289) is a 3β-sterol (CHEBI:35348)
4α-hydroxymethyl-4β-methylzymosterol (CHEBI:87289) is a diol (CHEBI:23824)
IUPAC Name 
4α-(hydroxymethyl)-4-methyl-5α-cholesta-8,24-dien-3β-ol
Synonym  Source
(3β,4α,5α)-4-(hydroxymethyl)-4-methylcholesta-8,24-dien-3-olIUPAC
UniProt Name  Source
4α-hydroxymethyl-4β-methylzymosterolUniProt
Manual XrefsDatabases
HMDB0012170HMDB
CPD-4575MetaCyc