compound 0102439

Properties Image MNX_ID MNXM1197087 reference envipathM:...5b156d705721 formula C12H21N2O6 global charge -1 mol weight 289.308 InChIKey LKHADWRGECYQRS-UHFFFAOYSA-M InChI InChI=1S/C12H22N2O6/c1-5-14(6-2)7-9(16)13-12(20,8(3)15)11(4,19)10(17)18/h19-20H,5-7H2,1-4H3,(H,13,16)(H,17,18)/p-1 SMILES CCN(CC)C/C(O)=N/C(O)(C(C)=O)C(C)(O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C12H22N2O6/c1-5-14(6-2)7-9(16)13-12(20,8(3)15)11(4,19)10(17)18/h19-20H,5-7H2,1-4H3,(H,13,16)(H,17,18)/t11?,12? SMILES (mnx) [CH3:1][CH2:5][N:14]([CH2:6][CH3:2])[CH2:7][C:9](=[N:13][C:12]([C:8]([CH3:3])=[O:15])([C:11]([CH3:4])([C:10](=[O:17])[OH:18])[OH:19])[OH:20])[OH:16]

Parent-child relations graph

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