compound 0280248

Properties Image MNX_ID MNXM1139082 reference envipathM:...cce8a5b2a244 formula C10H14N2O6 global charge -2 mol weight 258.23 InChIKey KZJWVXIYWPRIDB-XGICHPGQSA-L InChI InChI=1S/C10H16N2O6/c1-11-4-2-3-7(13)6(5-12-10(17)18)8(14)9(15)16/h5-6,8,11,14H,2-4H2,1H3,(H,15,16)(H,17,18)/p-2/b12-5- SMILES CNCCCC(=O)C(/C=N\C(=O)[O-])C(O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C10H16N2O6/c1-11-4-2-3-7(13)6(5-12-10(17)18)8(14)9(15)16/h5-6,8,11,14H,2-4H2,1H3,(H,15,16)(H,17,18)/b12-5-/t6?,8? SMILES (mnx) [CH3:1][NH:11][CH2:4][CH2:2][CH2:3][C:7]([CH:6](/[CH:5]=[N:12]\[C:10](=[O:17])[OH:18])[CH:8]([C:9](=[O:15])[OH:16])[OH:14])=[O:13]

Parent-child relations graph

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