Molecule ID: 5281758

IUPAC Name: 1,2,4-trimethoxy-5-[(Z)-prop-1-enyl]benzene

Description: The molecule is a phenylpropanoid that is benzene substituted by methoxy groups at positions 1, 2 and 4 and a propen-1-yl group at position 5. It has been isolated from Acorus. It has a role as a plant metabolite. It is a phenylpropanoid and a member of methoxybenzenes.

SMILES: C/C=C\c1cc(OC)c(OC)cc1OC

SELFIES: [C][/C][=C][\C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][#Branch2][O][C]

InChI: InChI=1S/C12H16O3/c1-5-6-9-7-11(14-3)12(15-4)8-10(9)13-2/h5-8H,1-4H3/b6-5-

Molecular Properties:
- Polar Surface Area: 27.7 Ų
- LogP: 3.0