compound 0229003

Properties Image MNX_ID MNXM1191746 reference envipathM:...fc198d188b28 formula C9H10N2O6 global charge -2 mol weight 242.187 InChIKey IHEIPTLFCIDVEF-LOQMQEDUSA-L InChI InChI=1S/C9H12N2O6/c10-2-5(6(12)3-11)4(1-7(13)14)8(15)9(16)17/h1-2,6,12H,3,10-11H2,(H,13,14)(H,16,17)/p-2/b4-1-,5-2- SMILES N/C=C(C(=C/C(=O)[O-])/C(=O)C(=O)[O-])\C(O)CN MNX internals InChI (mnx) InChI=1/C9H12N2O6/c10-2-5(6(12)3-11)4(1-7(13)14)8(15)9(16)17/h1-2,6,12H,3,10-11H2,(H,13,14)(H,16,17)/b4-1-,5-2-/t6? SMILES (mnx) [CH:1](=[C:4]([C:5](=[CH:2]/[NH2:10])/[CH:6]([CH2:3][NH2:11])[OH:12])\[C:8]([C:9]([OH:16])=[O:17])=[O:15])\[C:7](=[O:13])[OH:14]

Parent-child relations graph

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