EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:52384 - zymosteryl oleate

ChEBI IDCHEBI:52384
ChEBI Namezymosteryl oleate
Stars
Last Modified21 January 2016
Submitterkieran
DownloadsMolfile
FormulaC45H76O2
Net Charge0
Average Mass649.101
Monoisotopic Mass648.58453
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](OC(=O)CCCCCCC/C=C\CCCCCCCC)C2
InChIInChI=1S/C45H76O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h14-15,23,36-38,40-41H,7-13,16-22,24-34H2,1-6H3/b15-14-/t36-,37+,38+,40-,41+,44+,45-/m1/s1
InChIKeyUQDRGTMESOOVKB-LBIJMCEOSA-N
Species of MetaboliteComponentSourceComments
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Biological Role:
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
zymosteryl oleate (CHEBI:52384) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
zymosteryl oleate (CHEBI:52384) is a zymosterol ester (CHEBI:52322)
IUPAC Name 
5α-cholesta-8,24-dien-3β-yl (9Z)-octadec-9-enoate