Molecule ID: 14608480

IUPAC Name: 1,7-bis(4-hydroxyphenyl)heptan-3-one

Description: The molecule is a diarylheptanoid that is 3-heptanone substituted by a 4-hydroxyphenyl group at positions 1 and 7 respectively. It has been isolated from the rhizomes of Curcuma kwangsiensis. It has a role as a plant metabolite. It is a diarylheptanoid, a member of phenols and a ketone.

SMILES: O=C(CCCCc1ccc(O)cc1)CCc1ccc(O)cc1

SELFIES: [O][=C][Branch1][S][C][C][C][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]

InChI: InChI=1S/C19H22O3/c20-17(10-7-16-8-13-19(22)14-9-16)4-2-1-3-15-5-11-18(21)12-6-15/h5-6,8-9,11-14,21-22H,1-4,7,10H2

Molecular Properties:
- Polar Surface Area: 57.5 Ų
- LogP: 3.9