CHEBI:69548 - egonol oleate

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ChEBI Name egonol oleate
ChEBI ID CHEBI:69548
Definition A fatty acid ester obtained by the formal condensation of egonol with oleic acid. It has been isolated from the fruits of Styrax agrestis.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
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Formula C37H50O6
Net Charge 0
Average Mass 590.78930
Monoisotopic Mass 590.36074
InChI InChI=1S/C37H50O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-36(38)40-23-18-19-29-24-31-27-33(43-37(31)35(25-29)39-2)30-21-22-32-34(26-30)42-28-41-32/h10-11,21-22,24-27H,3-9,12-20,23,28H2,1-2H3/b11-10-
InChIKey GVZWPCDBHBSBHJ-KHPPLWFESA-N
SMILES CCCCCCCC\C=C/CCCCCCCC(=O)OCCCc1cc(OC)c2oc(cc2c1)-c1ccc2OCOc2c1
Metabolite of Species Details
Styrax agrestis (NCBI:txid153522) Found in ripe fruit (PO:0007038). Dried, powdered fruits were extracted with ethylacetate. 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing egonol oleate (CHEBI:69548) has functional parent egonol (CHEBI:69558)
egonol oleate (CHEBI:69548) has functional parent oleic acid (CHEBI:16196)
egonol oleate (CHEBI:69548) has parent hydride 1-benzofuran (CHEBI:35260)
egonol oleate (CHEBI:69548) has role plant metabolite (CHEBI:76924)
egonol oleate (CHEBI:69548) is a 1-benzofurans (CHEBI:38830)
egonol oleate (CHEBI:69548) is a aromatic ether (CHEBI:35618)
egonol oleate (CHEBI:69548) is a benzodioxoles (CHEBI:38298)
egonol oleate (CHEBI:69548) is a fatty acid ester (CHEBI:35748)
Incoming 7-demethoxyegonol oleate (CHEBI:69549) has functional parent egonol oleate (CHEBI:69548)
IUPAC Name
3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propyl (9Z)-octadec-9-enoate
Registry Number Type Source
15889611 Reaxys Registry Number Reaxys
Citation
Last Modified
09 January 2014