compound 0236735

Properties Image MNX_ID MNXM1189100 reference envipathM:...ce78f87d978a formula C12H8N2O8S global charge -2 mol weight 340.269 InChIKey NPTGDPKEKILITO-UHFFFAOYSA-L InChI InChI=1S/C12H10N2O8S/c15-7-3-1-5(9(16)11(7)18)13-14-6-2-4-8(23(20,21)22)12(19)10(6)17/h1-4,15-19H,(H,20,21,22)/p-2 SMILES O=S(=O)([O-])C1=CC=C(N=NC2=CC=C([O-])C(O)=C2O)C(O)=C1O MNX internals InChI (mnx) InChI=1/C12H10N2O8S/c15-7-3-1-5(9(16)11(7)18)13-14-6-2-4-8(23(20,21)22)12(19)10(6)17/h1-4,15-19H,(H,20,21,22)/b14-13? SMILES (mnx) [CH:1]1=[CH:3][C:7]([OH:15])=[C:11]([OH:18])[C:9]([OH:16])=[C:5]1[N:13]=[N:14][C:6]1=[C:10]([OH:17])[C:12]([OH:19])=[C:8]([S:23]([OH:20])(=[O:21])=[O:22])[CH:4]=[CH:2]1

Parent-child relations graph

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