Molecule ID: 101087010

IUPAC Name: (2Z,4E)-4-hydroxy-6-oxoocta-2,4-dienedioic acid

Description: The molecule is an oxodicarboxylic acid that is a tautomer of 4-maleylacetoacetic acid in which the carbonyl of the alpha,beta-unsaturated ketone moiety has tautomerised to the corresponding enol (the 2Z,4E isomer). It is an oxo dicarboxylic acid and an enol. It is a tautomer of a 4-maleylacetoacetic acid.

SMILES: O=C(O)/C=C\C(O)=C/C(=O)CC(=O)O

SELFIES: [O][=C][Branch1][C][O][/C][=C][\C][Branch1][C][O][=C][/C][=Branch1][C][=O][C][C][=Branch1][C][=O][O]

InChI: InChI=1S/C8H8O6/c9-5(1-2-7(11)12)3-6(10)4-8(13)14/h1-3,9H,4H2,(H,11,12)(H,13,14)/b2-1-,5-3+

Molecular Properties:
- Polar Surface Area: 112.0 Ų
- LogP: 0.0