2,5-didehydro-D-gluconate

Properties Image MNX_ID MNXM936 reference chebi:11449 formula C6H7O7 global charge -1 mol weight 191.115 InChIKey RXMWXENJQAINCC-DMTCNVIQSA-M InChI InChI=1S/C6H8O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h3-4,7,9-10H,1H2,(H,12,13)/p-1/t3-,4+/m1/s1 SMILES O=C([O-])C(=O)[C@@H](O)[C@H](O)C(=O)CO MNX internals InChI (mnx) InChI=1/C6H8O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h3-4,7,9-10H,1H2,(H,12,13)/t3-,4+/m1/s1 SMILES (mnx) [CH2:1]([C:2]([C@H:3]([C@@H:4]([C:5]([C:6]([OH:12])=[O:13])=[O:11])[OH:10])[OH:9])=[O:8])[OH:7]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 15 in models (compartimentalized) 8