D-Tagaturonate

Properties Image MNX_ID MNXM728349 reference keggC:C00558 formula C6H10O7 global charge 0 mol weight 194.139 InChIKey PTCIWUZVDIQTOW-QNZBUJBTSA-N InChI InChI=1S/C6H10O7/c7-1-6(12)4(9)2(8)3(13-6)5(10)11/h2-4,7-9,12H,1H2,(H,10,11)/t2-,3-,4-,6?/m0/s1 SMILES O=C(O)[C@H]1OC(O)(CO)[C@@H](O)[C@H]1O MNX internals InChI (mnx) InChI=1/C6H10O7/c7-1-6(12)4(9)2(8)3(13-6)5(10)11/h2-4,7-9,12H,1H2,(H,10,11)/t2-,3-,4-,6?/m0/s1 SMILES (mnx) [CH2:1]([C:6]1([OH:12])[C@@H:4]([OH:9])[C@@H:2]([OH:8])[C@@H:3]([C:5](=[O:10])[OH:11])[O:13]1)[OH:7]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 8 in models (compartimentalized) 6