compound 0073022

Properties Image MNX_ID MNXM1182275 reference envipathM:...fb49cf0cda55 formula C13H9NO7 global charge -2 mol weight 291.215 InChIKey UBROTSQBNQYEFW-UHFFFAOYSA-L InChI InChI=1S/C13H11NO7/c1-2-13(21,10(16)11(17)18)9(15)7-3-5-8(6-4-7)14-12(19)20/h2-6,14,21H,1H2,(H,17,18)(H,19,20)/p-2 SMILES C=CC(O)(C(=O)C(=O)[O-])C(=O)C1=CC=C(NC(=O)[O-])C=C1 MNX internals InChI (mnx) InChI=1/C13H11NO7/c1-2-13(21,10(16)11(17)18)9(15)7-3-5-8(6-4-7)14-12(19)20/h2-6,14,21H,1H2,(H,17,18)(H,19,20)/t13? SMILES (mnx) [CH2:1]=[CH:2][C:13]([C:9]([C:7]1=[CH:4][CH:6]=[C:8]([NH:14][C:12](=[O:19])[OH:20])[CH:5]=[CH:3]1)=[O:15])([C:10]([C:11]([OH:17])=[O:18])=[O:16])[OH:21]

Parent-child relations graph

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