compound 0067987

Properties Image MNX_ID MNXM1193159 reference envipathM:...8f8dbab9e4dd formula C9H12NO5 global charge -1 mol weight 214.197 InChIKey IWKVKPYVZCSXDH-GQCTYLIASA-M InChI InChI=1S/C9H13NO5/c1-6(3-7(11)9(13)14)4-10-8(12)5-15-2/h4H,3,5H2,1-2H3,(H,10,12)(H,13,14)/p-1/b6-4+ SMILES COCC(=O)N/C=C(\C)CC(=O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C9H13NO5/c1-6(3-7(11)9(13)14)4-10-8(12)5-15-2/h4H,3,5H2,1-2H3,(H,10,12)(H,13,14)/b6-4+ SMILES (mnx) [CH3:1]/[C:6]([CH2:3][C:7]([C:9]([OH:13])=[O:14])=[O:11])=[CH:4]\[N:10]=[C:8](\[CH2:5][O:15][CH3:2])[OH:12]

Parent-child relations graph

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