2-chloro-4-methyl-cis,cis-muconate

Properties Image MNX_ID MNXM8056 reference metacycM:CPD-10643 formula C7H5ClO4 global charge -2 mol weight 188.566 InChIKey RPZYZLTUMGKDMA-YMDHRIDOSA-L InChI InChI=1S/C7H7ClO4/c1-4(3-6(9)10)2-5(8)7(11)12/h2-3H,1H3,(H,9,10)(H,11,12)/p-2/b4-3-,5-2+ SMILES CC(=C/C(=O)[O-])/C=C(/Cl)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C7H7ClO4/c1-4(3-6(9)10)2-5(8)7(11)12/h2-3H,1H3,(H,9,10)(H,11,12)/b4-3-,5-2+ SMILES (mnx) [CH3:1][C:4](/[CH:2]=[C:5](\[C:7](=[O:11])[OH:12])[Cl:8])=[CH:3]/[C:6](=[O:9])[OH:10]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0