Molecule ID: 54675784

IUPAC Name: (2E,4Z)-2-hydroxy-5-methylhexa-2,4-dienedioic acid

Description: The molecule is a dicarboxylic acid that is cis,cis-muconic acid in which the hydrogens at positions 2 and 5 are substituted by hydroxy and methyl groups, respectively. It is an enol and a polyunsaturated dicarboxylic acid. It derives from a cis,cis-muconic acid.

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

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

InChI: InChI=1S/C7H8O5/c1-4(6(9)10)2-3-5(8)7(11)12/h2-3,8H,1H3,(H,9,10)(H,11,12)/b4-2-,5-3+

Molecular Properties:
- Polar Surface Area: 94.8 Ų
- LogP: 0.4