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CHEBI:136486 - 3-dehydro-4α-methylzymosterol

ChEBI IDCHEBI:136486
ChEBI Name3-dehydro-4α-methylzymosterol
Stars
ASCII Name3-dehydro-4alpha-methylzymosterol
DefinitionA 3-dehydro-4-methylzymosterol in which the methyl substituent at position 4 has α configuration. It is an intermediate in the biosynthesis of cholesterol.
Last Modified16 July 2021
Submitterlaimo
DownloadsMolfile
FormulaC28H44O
Net Charge0
Average Mass396.659
Monoisotopic Mass396.33922
SMILES[H][C@@]12CC[C@]([H])([C@H](C)CCC=C(C)C)[C@@]1(C)CCC1=C2CC[C@@]2([H])[C@H](C)C(=O)CC[C@]12C
InChIInChI=1S/C28H44O/c1-18(2)8-7-9-19(3)22-12-13-24-21-10-11-23-20(4)26(29)15-17-28(23,6)25(21)14-16-27(22,24)5/h8,19-20,22-24H,7,9-17H2,1-6H3/t19-,20+,22-,23+,24+,27-,28+/m1/s1
InChIKeyDBPZYKHQDWKORQ-SINUOACOSA-N
Roles Classification
Biological Roles:
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
3-dehydro-4α-methylzymosterol (CHEBI:136486) is a 3-dehydro-4-methylzymosterol (CHEBI:50593)
IUPAC Name 
4α-methyl-5α-cholesta-8,24-dien-3-one
Synonyms  Source
(4α,5α)-4-methylcholesta-8,24-dien-3-oneChEBI
3-keto-4α-methylzymosterolChEBI
3-keto-4α-methyl-zymosterolLIPID MAPS
UniProt Name  Source
3-dehydro-4α-methylzymosterolUniProt
Manual XrefsDatabases
HMDB0000981HMDB
LMST01010237LIPID MAPS
Registry NumbersSources
CAS:7377-73-3HMDB