iso-arabidopate

Properties Image MNX_ID MNXM168015 reference metacycM:CPD-18135 formula C9H4O6 global charge -2 mol weight 208.125 InChIKey VVFYEUKYTLSHRZ-DUXPYHPUSA-L InChI InChI=1S/C9H6O6/c10-7(11)4-2-5-1-3-6(8(12)13)15-9(5)14/h1-4H,(H,10,11)(H,12,13)/p-2/b4-2+ SMILES O=C([O-])/C=C/C1=CC=C(C(=O)[O-])OC1=O MNX internals InChI (mnx) InChI=1/C9H6O6/c10-7(11)4-2-5-1-3-6(8(12)13)15-9(5)14/h1-4H,(H,10,11)(H,12,13)/b4-2+ SMILES (mnx) [CH:1]1=[C:5](/[CH:2]=[CH:4]/[C:7](=[O:10])[OH:11])[C:9](=[O:14])[O:15][C:6]([C:8]([OH:12])=[O:13])=[CH:3]1

Parent-child relations graph

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