CHEBI:69558 - egonol

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ChEBI Name egonol
ChEBI ID CHEBI:69558
Definition A member of the class of 1-benzofurans that is 1-benzofuran substituted by a methoxy group at position 7, a 1,3-benzodioxol-5-yl group at position 2 and a 3-hydroxypropyl group at position 5. It has been isolated from Styrax agrestis.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C19H18O5
Net Charge 0
Average Mass 326.34320
Monoisotopic Mass 326.11542
InChI InChI=1S/C19H18O5/c1-21-18-8-12(3-2-6-20)7-14-10-16(24-19(14)18)13-4-5-15-17(9-13)23-11-22-15/h4-5,7-10,20H,2-3,6,11H2,1H3
InChIKey VOLZBKQSLGCZGC-UHFFFAOYSA-N
SMILES COc1cc(CCCO)cc2cc(oc12)-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 (CHEBI:69558) has parent hydride 1-benzofuran (CHEBI:35260)
egonol (CHEBI:69558) has role plant metabolite (CHEBI:76924)
egonol (CHEBI:69558) is a 1-benzofurans (CHEBI:38830)
egonol (CHEBI:69558) is a aromatic ether (CHEBI:35618)
egonol (CHEBI:69558) is a benzodioxoles (CHEBI:38298)
egonol (CHEBI:69558) is a primary alcohol (CHEBI:15734)
Incoming 7-demethoxyegonol (CHEBI:69557) has functional parent egonol (CHEBI:69558)
egonol β-D-glucoside (CHEBI:134480) has functional parent egonol (CHEBI:69558)
egonol acetate (CHEBI:69556) has functional parent egonol (CHEBI:69558)
egonol oleate (CHEBI:69548) has functional parent egonol (CHEBI:69558)
egonol-2ʼʼʼ-methyl butanoate (CHEBI:69550) has functional parent egonol (CHEBI:69558)
egonol-2-methylpropanoate (CHEBI:69554) has functional parent egonol (CHEBI:69558)
egonol-9(Z),12(Z)linoleate (CHEBI:69546) has functional parent egonol (CHEBI:69558)
egonolbutanoate (CHEBI:69555) has functional parent egonol (CHEBI:69558)
egonolpropanoate (CHEBI:69553) has functional parent egonol (CHEBI:69558)
IUPAC Name
3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propan-1-ol
Synonym Source
2-(1,3-benzodioxol-5-yl)-7-methoxy-5-benzofuranpropanol HMDB
Manual Xrefs Databases
HMDB0034279 HMDB
KR20090099899 Patent
View more database links
Registry Number Type Source
336565 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
15643559 PubMed citation Europe PMC
16206040 PubMed citation Europe PMC
21939219 PubMed citation Europe PMC
Last Modified
03 July 2017