compound 0105925

Properties Image MNX_ID MNXM1195373 reference envipathM:...6d7853a2e9b8 formula C8H11N2O6 global charge -1 mol weight 231.184 InChIKey ZSLAXISXVXNEQD-WTDSWWLTSA-M InChI InChI=1S/C8H12N2O6/c1-3(5(12)6(13)8(15)16)7(14)10-2-4(9)11/h2-4,7,11,14H,9H2,1H3,(H,15,16)/p-1/b10-2+ SMILES CC(C(=O)C(=O)C(=O)[O-])C(O)/N=C/C(N)O MNX internals InChI (mnx) InChI=1/C8H12N2O6/c1-3(5(12)6(13)8(15)16)7(14)10-2-4(9)11/h2-4,7,11,14H,9H2,1H3,(H,15,16)/b10-2+/t3?,4?,7? SMILES (mnx) [CH3:1][CH:3]([C:5]([C:6]([C:8](=[O:15])[OH:16])=[O:13])=[O:12])[CH:7](/[N:10]=[CH:2]/[CH:4]([NH2:9])[OH:11])[OH:14]

Parent-child relations graph

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