4-Oxalomesaconate

• Formula: C₇H₃O₇^3-

• MW: 199.1

• SMILES String: [O-]C(=O)\C=C(/CC(=O)C([O-])=O)C([O-])=O

• Synonyms: (E)-4-Oxobut-1-ene-1,2,4-tricarboxylate; 3-Carboxy-5-oxo-2-hexenedioic acid; 4-Oxalmesaconic acid

• CAS Reg. 85179-60-8

• PubChem Substance Entry

• Common metabolism (KEGG)

• EAWAG-BBD reactions whose product is 4-Oxalomesaconate
  • 4-Carboxy-2-hydroxy-6-methoxy-6-oxohexa-2,4-dienoate -----> 4-Oxalomesaconate (reacID# r1640)
  • Gallate -----> 4-Oxalomesaconate (reacID# r1673)
  • 2-Pyrone-4,6-dicarboxylate -----> 4-Oxalomesaconate (reacID# r1641)

Page Author(s): Jeanna Danielson
November 08, 2013 Contact Us

This is the EAWAG-BBD compound, compID# c1411.
It was generated on January 31, 2025 at 7:38:01 AM CST.

© 2025, EAWAG.