CHEBI:50593 - 3-dehydro-4-methylzymosterol

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ChEBI Name 3-dehydro-4-methylzymosterol
ChEBI ID CHEBI:50593
Definition A 3-oxo-5α- steroid that is zymosterol which has been substituted by a methyl group at C-4, and in which the 3-hydroxy function has been oxidised to an oxo group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C28H44O
Net Charge 0
Average Mass 396.64836
Monoisotopic Mass 396.33922
InChI InChI=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
InChIKey DBPZYKHQDWKORQ-MWEYQPRESA-N
SMILES [H][C@@]12CCC3=C(CC[C@]4(C)[C@]([H])(CC[C@@]34[H])[C@H](C)CCC=C(C)C)[C@@]1(C)CCC(=O)C2C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3-dehydro-4-methylzymosterol (CHEBI:50593) has functional parent zymosterol (CHEBI:18252)
3-dehydro-4-methylzymosterol (CHEBI:50593) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
3-dehydro-4-methylzymosterol (CHEBI:50593) has role human metabolite (CHEBI:77746)
3-dehydro-4-methylzymosterol (CHEBI:50593) has role mouse metabolite (CHEBI:75771)
3-dehydro-4-methylzymosterol (CHEBI:50593) is a 3-oxo-5α-steroid (CHEBI:13601)
3-dehydro-4-methylzymosterol (CHEBI:50593) is a cholestanoid (CHEBI:50401)
Incoming 3-dehydro-4α-methylzymosterol (CHEBI:136486) is a 3-dehydro-4-methylzymosterol (CHEBI:50593)
IUPAC Name
4-methyl-5α-cholesta-8,24-dien-3-one
Synonyms Sources
(5α)-4-methylcholesta-8,24-dien-3-one ChEBI
3-Keto-4-methylzymosterol KEGG COMPOUND
4-methyl-5α-cholesta-8(9),24-dien-3-one ChEBI
4α-methyl-5α-cholesta-8,24-dien-3-one UniProt
Manual Xref Database
C15816 KEGG COMPOUND
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Last Modified
28 March 2017