Molecule ID: 151725

IUPAC Name: 2-(3,4-dihydroxyphenyl)-2-hydroxyacetaldehyde

Description: The molecule is an aldehyde consisting of phenylacetaldehyde having three hydroxy substituents located at the alpha-, 3- and 4-positions It has a role as a metabolite, a neurotoxin and a mouse metabolite. It is a member of catechols and an aldehyde.

SMILES: O=CC(O)c1ccc(O)c(O)c1

SELFIES: [O][=C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2]

InChI: InChI=1S/C8H8O4/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-4,8,10-12H

Molecular Properties:
- Polar Surface Area: 77.8 Ų
- LogP: -0.6