tricarballylate

Properties Image MNX_ID MNXM4854 reference chebi:62517 formula C6H5O6 global charge -3 mol weight 173.1 InChIKey KQTIIICEAUMSDG-UHFFFAOYSA-K InChI InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3 SMILES O=C([O-])CC(CC(=O)[O-])C(=O)[O-] MNX internals InChI (mnx) InChI=1/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12) SMILES (mnx) [CH2:1]([CH:3]([CH2:2][C:5](=[O:9])[OH:10])[C:6](=[O:11])[OH:12])[C:4](=[O:7])[OH:8]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 7 in models (compartimentalized) 5