Molecule ID: 54724344

IUPAC Name: (Z)-4,7-dihydroxy-6-oxido-7-oxohept-5-enoate

Description: The molecule is dicarboxylate anion of 2,4-dihydroxyhept-2-enedioic acid. It is a conjugate base of a 2,4-dihydroxyhept-2-enedioic acid. It is a tautomer of a 4-hydroxy-2-oxoheptanedioate.

SMILES: O=C([O-])CCC(O)/C=C(\[O-])C(=O)O

SELFIES: [O][=C][Branch1][C][O-1][C][C][C][Branch1][C][O][/C][=C][Branch1][C][\O-1][C][=Branch1][C][=O][O]

InChI: InChI=1S/C7H10O6/c8-4(1-2-6(10)11)3-5(9)7(12)13/h3-4,8-9H,1-2H2,(H,10,11)(H,12,13)/p-2/b5-3-

Molecular Properties:
- Polar Surface Area: 121.0 Ų
- LogP: 0.4