Molecule ID: 54692812

IUPAC Name: (1E,3Z)-4-hydroxybuta-1,3-diene-1,2,4-tricarboxylic acid

Description: The molecule is a 4-carboxy-2-hydroxyhexa-2,4-dienedioic acid having (2Z,4E)-configuration about the C=C double bonds. It is a conjugate acid of a (2Z,4E)-4-carboxylato-2-hydroxyhexa-2,4-dienedioate(3-).

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

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

InChI: InChI=1S/C7H6O7/c8-4(7(13)14)1-3(6(11)12)2-5(9)10/h1-2,8H,(H,9,10)(H,11,12)(H,13,14)/b3-2+,4-1-

Molecular Properties:
- Polar Surface Area: 132.0 Ų
- LogP: -0.6