CHEBI:17791 - obtusifoliol

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ChEBI Name obtusifoliol
ChEBI ID CHEBI:17791
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:7717, CHEBI:14678, CHEBI:25624
Supplier Information ChemicalBook:CB31370266, ZINC000004095752
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Formula C30H50O
Net Charge 0
Average Mass 426.729
Monoisotopic Mass 426.38617
InChI InChI=1S/C30H50O/c1-19(2)20(3)9-10-21(4)23-13-17-30(8)26-12-11-24-22(5)27(31)15-16-28(24,6)25(26)14-18-29(23,30)7/h19,21-24,27,31H,3,9-18H2,1-2,4-8H3/t21-,22+,23-,24+,27+,28+,29-,30+/m1/s1
InChIKey MMNYKQIDRZNIKT-VSADUBDNSA-N
SMILES [H][C@@]1(CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)[C@@H](C)[C@]1([H])CC3)[C@H](C)CCC(=C)C(C)C
Metabolite of Species Details
Euphorbia sogdiana (IPNI:348300-1) Found in aerial part (BTO:0001658). See: PubMed
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing obtusifoliol (CHEBI:17791) has parent hydride 5α-ergostane (CHEBI:20652)
obtusifoliol (CHEBI:17791) has role mouse metabolite (CHEBI:75771)
obtusifoliol (CHEBI:17791) has role plant metabolite (CHEBI:76924)
obtusifoliol (CHEBI:17791) is a 14α-methyl steroid (CHEBI:138029)
obtusifoliol (CHEBI:17791) is a 3β-sterol (CHEBI:35348)
IUPAC Name
4α,14-dimethyl-5α-ergosta-8,24(28)-dien-3β-ol
Synonyms Sources
(+)-obtusifoliol HMDB
(3β,4α,5α)-4,14-dimethylergosta-8,24(28)-dien-3-ol ChEBI
4alpha,14alpha-Dimethyl-24-methylene-5alpha-cholesta-8-en-3beta-ol KEGG COMPOUND
4α,14α-dimethyl-24-methylene-cholest-8-en-3β-ol LIPID MAPS
4alpha,14alpha-Dimethyl-5alpha-ergosta-8,24(28)-dien-3beta-ol KEGG COMPOUND
4α,14α-dimethyl-Δ8,24(28)-ergostadien-3β-ol ChEBI
obtusifoliol UniProt
Manual Xrefs Databases
C00007368 KNApSAcK
C01943 KEGG COMPOUND
FDB004683 FooDB
HMDB0001242 HMDB
LMST01030101 LIPID MAPS
Obtusifoliol Wikipedia
OBTUSIFOLIOL MetaCyc
View more database links
Registry Number Type Source
16910-32-0 CAS Registry Number KEGG COMPOUND
Citations Waiting for Citations
Last Modified
18 May 2023