Molecule ID: 67249

IUPAC Name: 2-(4-hydroxyphenyl)chromenylium-3,5,7-triol;chloride

Description: The molecule is an anthocyanidin chloride that has pelargonidin as the cationic counterpart. It has a role as a phytoestrogen and a plant metabolite. It contains a pelargonidin.

SMILES: Cl.[O-]c1cc2c(O)cc(O)cc2[o+]c1-c1ccc(O)cc1

SELFIES: [Cl].[O-1][C][=C][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][=C][Ring1][Branch2][O+1][=C][Ring1][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]

InChI: InChI=1S/C15H10O5.ClH/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15;/h1-7H,(H3-,16,17,18,19);1H

Molecular Properties:
- Polar Surface Area: 81.9 Ų
- LogP: nan