compound 0075537

Properties Image MNX_ID MNXM1179293 reference envipathM:...9309813844eb formula C13H7NO8 global charge -2 mol weight 305.198 InChIKey DVAIHCVBAPYXIO-UHFFFAOYSA-L InChI InChI=1S/C13H9NO8/c15-5-14-7-3-1-6(2-4-7)9(16)8(10(17)12(19)20)11(18)13(21)22/h1-4,8,10,17H,(H,19,20)(H,21,22)/p-2 SMILES O=C=NC1=CC=C(C(=O)C(C(=O)C(=O)[O-])C(O)C(=O)[O-])C=C1 MNX internals InChI (mnx) InChI=1/C13H9NO8/c15-5-14-7-3-1-6(2-4-7)9(16)8(10(17)12(19)20)11(18)13(21)22/h1-4,8,10,17H,(H,19,20)(H,21,22)/t8?,10? SMILES (mnx) [CH:1]1=[CH:3][C:7]([N:14]=[C:5]=[O:15])=[CH:4][CH:2]=[C:6]1[C:9]([CH:8]([CH:10]([C:12](=[O:19])[OH:20])[OH:17])[C:11]([C:13]([OH:21])=[O:22])=[O:18])=[O:16]

Parent-child relations graph

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