1-(4-methoxyphenyl)-3-pyrrolidin-1-ylpropan-1-one
1-(4-methoxyphenyl)-3-pyrrolidin-1-ylpropan-1-one is the pyrrolidine alkaloid form of the allylbenzene methyl chavicol. This is a possible metabolite of methyl chavicol. Similar metabolites are proven to form in vivo for safrole, elemicin, and several other allylbenzenes (see their individual articles for references).
See Also
PubChem Compound ID: 199918
Molecular Weight: 233.30616 [g/mol]
Molecular Formula: C14H19NO2
XLogP3-AA: 2
IUPAC Name: 1-(4-methoxyphenyl)-3-pyrrolidin-1-ylpropan-1-one
InChI: InChI=1S/C14H19NO2/c1-17-13-6-4-12(5-7-13)14(16)8-11-15-9-2-3-10-15/h4-7H,2-3,8-11H2,1H3
InChIKey: JWDNYWPERHRMIN-UHFFFAOYSA-N
Canonical SMILES: COC1=CC=C(C=C1)C(=O)CCN2CCCC2
page revision: 5, last edited: 04 Mar 2013 11:59