compound 0107496

Properties Image MNX_ID MNXM1180628 reference envipathM:...2694bae91cac formula C11H17N2O7 global charge -1 mol weight 289.264 InChIKey NRFSSJSTYIMMSL-XBXARRHUSA-M InChI InChI=1S/C11H18N2O7/c1-7(16)13(2-3-14)5-9(17)12-4-8(6-15)10(18)11(19)20/h3-4,7,10,15-16,18H,2,5-6H2,1H3,(H,12,17)(H,19,20)/p-1/b8-4+ SMILES CC(O)N(CC=O)C/C(O)=N/C=C(\CO)C(O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C11H18N2O7/c1-7(16)13(2-3-14)5-9(17)12-4-8(6-15)10(18)11(19)20/h3-4,7,10,15-16,18H,2,5-6H2,1H3,(H,12,17)(H,19,20)/b8-4+/t7?,10? SMILES (mnx) [CH3:1][CH:7]([N:13]([CH2:2][CH:3]=[O:14])[CH2:5]/[C:9](=[N:12]/[CH:4]=[C:8](\[CH2:6][OH:15])[CH:10]([C:11](=[O:19])[OH:20])[OH:18])[OH:17])[OH:16]

Parent-child relations graph

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