compound 0100357

Properties Image MNX_ID MNXM1176306 reference envipathM:...42e9675d8eb0 formula C12H17N2O6 global charge -1 mol weight 285.276 InChIKey IZVCZJFZLCNXRU-TWGQIWQCSA-M InChI InChI=1S/C12H18N2O6/c1-2-14(3-4-15)7-11(18)13-6-9(8-16)5-10(17)12(19)20/h6,8,15H,2-5,7H2,1H3,(H,13,18)(H,19,20)/p-1/b9-6- SMILES CCN(CCO)C/C(O)=N/C=C(\C=O)CC(=O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C12H18N2O6/c1-2-14(3-4-15)7-11(18)13-6-9(8-16)5-10(17)12(19)20/h6,8,15H,2-5,7H2,1H3,(H,13,18)(H,19,20)/b9-6- SMILES (mnx) [CH3:1][CH2:2][N:14]([CH2:3][CH2:4][OH:15])[CH2:7]/[C:11](=[N:13]/[CH:6]=[C:9](/[CH2:5][C:10]([C:12]([OH:19])=[O:20])=[O:17])[CH:8]=[O:16])[OH:18]

Parent-child relations graph

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