3'-Hydroxyanethole
3'-Hydroxyanethole is a presumed metabolite of methyl chavicol. A similar metabolite known as 3'-hydroxymethylisoeugenol is proven to be made from the related allylbenzene methyl eugenol indicating that this route of metabolism is very possible for methyl chavicol. See this article for more details: 4-Methoxycinnamoylglycine.
Chemical Properties
PubChem Compound ID: 95641
Molecular Weight: 164.20108 [g/mol]
Molecular Formula: C10H12O2
XLogP3: 2.1
H-Bond Donor: 1
H-Bond Acceptor: 2
IUPAC Name: 3-(4-methoxyphenyl)prop-2-en-1-ol
InChI: InChI=1S/C10H12O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h2-7,11H,8H2,1H3
InChIKey: NYICIIFSBJOBKE-UHFFFAOYSA-N
Canonical SMILES : COC1=CC=C(C=C1)C=CCO
page revision: 4, last edited: 21 Feb 2013 08:02