(2E)-3-methyl-4,6-dioxohept-2-enedioate

Properties Image MNX_ID MNXM163950 reference metacycM:CPD-18273 formula C8H6O6 global charge -2 mol weight 198.13 InChIKey JOAPNSZVZABVIR-DUXPYHPUSA-L InChI InChI=1S/C8H8O6/c1-4(2-7(11)12)5(9)3-6(10)8(13)14/h2H,3H2,1H3,(H,11,12)(H,13,14)/p-2/b4-2+ SMILES C/C(=C\C(=O)[O-])C(=O)CC(=O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C8H8O6/c1-4(2-7(11)12)5(9)3-6(10)8(13)14/h2H,3H2,1H3,(H,11,12)(H,13,14)/b4-2+ SMILES (mnx) [CH3:1]/[C:4](=[CH:2]\[C:7](=[O:11])[OH:12])[C:5]([CH2:3][C:6]([C:8]([OH:13])=[O:14])=[O:10])=[O:9]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0