2-carboxymuconate

Properties Image MNX_ID MNXM14214 reference metacycM:2-CARBOXYMUCONATE formula C7H3O6 global charge -3 mol weight 183.095 InChIKey SLUDRBHRUDRZJZ-HNQUOIGGSA-K InChI InChI=1S/C7H6O6/c8-5(9)3-1-2-4(6(10)11)7(12)13/h1-3H,(H,8,9)(H,10,11)(H,12,13)/p-3/b3-1+ SMILES O=C([O-])/C=C/C=C(C(=O)[O-])C(=O)[O-] MNX internals InChI (mnx) InChI=1/C7H6O6/c8-5(9)3-1-2-4(6(10)11)7(12)13/h1-3H,(H,8,9)(H,10,11)(H,12,13)/b3-1+ SMILES (mnx) [CH:1](/[CH:2]=[C:4](/[C:6](=[O:10])[OH:11])[C:7](=[O:12])[OH:13])=[CH:3]\[C:5](=[O:8])[OH:9]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0