Summary
SMILES: C=CCc1ccc(c(c1)OC)OCInChI: InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4,6-8H,1,5H2,2-3H3InChIKey: ZYEMGPIYFIJGTP-UHFFFAOYSA-N
DeepSMILES: C=CCcccccc6)OC)))OC
Scaffold Graph/Node/Bond level: c1ccccc1
Scaffold Graph/Node level: C1CCCCC1
Scaffold Graph level: C1CCCCC1
Functional groups: C=CC; cOC
Chemical classification
ClassyFire Kingdom: Organic compounds
ClassyFire Superclass: BenzenoidsClassyFire Class: Benzene and substituted derivatives
ClassyFire Subclass: Methoxybenzenes
NP Classifier Biosynthetic pathway: Shikimates and Phenylpropanoids
NP Classifier Superclass: Phenylpropanoids (C6-C3)
NP Classifier Class: Cinnamic acids and derivatives
Synonymous chemical names:*methyleugenol, 1,2-dimethoxy-4-allyl-benzene, 3,4-dimethoxy-allyl-benzene, eugenol methyl ether, eugenol methylether, eugenol-methyl-ether, met h yleugenol, meth yleugenol, methyl eugenol, methyl euganol, methyl eugenol, methyl eugenol*, methyl eugenol4, methyl eugenyl ether, methyl-eugenol, methyleugenol, methyleujenol, metyl eugenol
External chemical identifiers:CID:7127; ChEMBL:CHEMBL108861; ChEBI:4918; ZINC:ZINC000000388674; FDASRS:29T9VA6R7M; SureChEMBL:SCHEMBL113794; MolPort-000-154-691
Chemical structure download