compound 0285519

Properties Image MNX_ID MNXM1191635 reference envipathM:...fd82d113c041 formula C7H6NO9S2 global charge -3 mol weight 312.257 InChIKey DWYNXCOFIUCIRJ-UHFFFAOYSA-K InChI InChI=1S/C7H9NO9S2/c9-3(10)1-6(13)7(14,2-4(11)12)18-5(8-6)19(15,16)17/h13-14H,1-2H2,(H,9,10)(H,11,12)(H,15,16,17)/p-3 SMILES O=C([O-])CC1(O)N=C(S(=O)(=O)[O-])SC1(O)CC(=O)[O-] MNX internals InChI (mnx) InChI=1/C7H9NO9S2/c9-3(10)1-6(13)7(14,2-4(11)12)18-5(8-6)19(15,16)17/h13-14H,1-2H2,(H,9,10)(H,11,12)(H,15,16,17)/t6?,7? SMILES (mnx) [CH2:1]([C:3](=[O:9])[OH:10])[C:6]1([OH:13])[C:7]([CH2:2][C:4](=[O:11])[OH:12])([OH:14])[S:18][C:5]([S:19]([OH:15])(=[O:16])=[O:17])=[N:8]1

Parent-child relations graph

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