compound 0110057

Properties Image MNX_ID MNXM1185306 reference envipathM:...5cb61c52ae34 formula C9H17N2O6 global charge -1 mol weight 249.243 InChIKey ZDUYBJJERHAEOC-UHFFFAOYSA-M InChI InChI=1S/C9H18N2O6/c1-3-10-5-6(12)11-9(16,17)8(2,15)4-7(13)14/h10,15-17H,3-5H2,1-2H3,(H,11,12)(H,13,14)/p-1 SMILES CCNC/C(O)=N/C(O)(O)C(C)(O)CC(=O)[O-] MNX internals InChI (mnx) InChI=1/C9H18N2O6/c1-3-10-5-6(12)11-9(16,17)8(2,15)4-7(13)14/h10,15-17H,3-5H2,1-2H3,(H,11,12)(H,13,14)/t8? SMILES (mnx) [CH3:1][CH2:3][NH:10][CH2:5][C:6](=[N:11][C:9]([C:8]([CH3:2])([CH2:4][C:7](=[O:13])[OH:14])[OH:15])([OH:16])[OH:17])[OH:12]

Parent-child relations graph

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