Molecule ID: 49831652

IUPAC Name: (E)-1,7-bis(4-hydroxyphenyl)hept-6-en-3-one

Description: The molecule is a diarylheptanoid that is hept-6-en-3-one substituted by a 4-hydroxyphenyl group at positions 1 and 7. 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(CC/C=C/c1ccc(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/C19H20O3/c20-17(10-7-16-8-13-19(22)14-9-16)4-2-1-3-15-5-11-18(21)12-6-15/h1,3,5-6,8-9,11-14,21-22H,2,4,7,10H2/b3-1+

Molecular Properties:
- Polar Surface Area: 57.5 Ų
- LogP: 3.7