compound 0107245

Properties Image MNX_ID MNXM1182032 reference envipathM:...408852d2acd1 formula C8H10NO7 global charge -1 mol weight 232.168 InChIKey KERXWQQWTYGQNZ-UHFFFAOYSA-M InChI InChI=1S/C8H11NO7/c1-2-8(16,9-5(12)3-10)7(15,4-11)6(13)14/h3-4,15-16H,2H2,1H3,(H,9,12)(H,13,14)/p-1 SMILES CCC(O)(/N=C(\O)C=O)C(O)(C=O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C8H11NO7/c1-2-8(16,9-5(12)3-10)7(15,4-11)6(13)14/h3-4,15-16H,2H2,1H3,(H,9,12)(H,13,14)/t7?,8? SMILES (mnx) [CH3:1][CH2:2][C:8]([C:7]([CH:4]=[O:11])([C:6](=[O:13])[OH:14])[OH:15])([NH:9][C:5]([CH:3]=[O:10])=[O:12])[OH:16]

Parent-child relations graph

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