2-dehydro-3,6-dideoxy-6-sulfo-D-gluconate

Properties Image MNX_ID MNXM162449 reference chebi:88094 formula C6H8O8S global charge -2 mol weight 240.189 InChIKey COLOZALSGXIPJV-WVZVXSGGSA-L InChI InChI=1S/C6H10O8S/c7-3(1-4(8)6(10)11)5(9)2-15(12,13)14/h3,5,7,9H,1-2H2,(H,10,11)(H,12,13,14)/p-2/t3-,5+/m0/s1 SMILES O=C([O-])C(=O)C[C@H](O)[C@H](O)CS(=O)(=O)[O-] MNX internals InChI (mnx) InChI=1/C6H10O8S/c7-3(1-4(8)6(10)11)5(9)2-15(12,13)14/h3,5,7,9H,1-2H2,(H,10,11)(H,12,13,14)/t3-,5+/m0/s1 SMILES (mnx) [CH2:1]([C@@H:3]([C@@H:5]([CH2:2][S:15]([OH:12])(=[O:13])=[O:14])[OH:9])[OH:7])[C:4]([C:6]([OH:10])=[O:11])=[O:8]

Parent-child relations graph

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