compound 0101961

Properties Image MNX_ID MNXM1193897 reference envipathM:...fc102b88d7e2 formula C7H9NO6 global charge -2 mol weight 203.15 InChIKey AJSFJQBOTJPBPA-UHFFFAOYSA-L InChI InChI=1S/C7H11NO6/c1-3(2-4(9)10)5(11)8-6(12)7(13)14/h3,5,11H,2H2,1H3,(H,8,12)(H,9,10)(H,13,14)/p-2 SMILES CC(CC(=O)[O-])C(O)/N=C(\O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C7H11NO6/c1-3(2-4(9)10)5(11)8-6(12)7(13)14/h3,5,11H,2H2,1H3,(H,8,12)(H,9,10)(H,13,14)/t3?,5? SMILES (mnx) [CH3:1][CH:3]([CH2:2][C:4](=[O:9])[OH:10])[CH:5]([NH:8][C:6]([C:7]([OH:13])=[O:14])=[O:12])[OH:11]

Parent-child relations graph

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