compound 0101559

Properties Image MNX_ID MNXM1196077 reference envipathM:...590f5e183b0e formula C14H22N2O8 global charge -2 mol weight 346.336 InChIKey PDAPBDHCRPNCCP-UHFFFAOYSA-L InChI InChI=1S/C14H24N2O8/c1-3-16(4-5-17)7-11(19)15-14(24,9(2)13(22)23)10(8-18)6-12(20)21/h8-10,17,24H,3-7H2,1-2H3,(H,15,19)(H,20,21)(H,22,23)/p-2 SMILES CCN(CCO)C/C(O)=N/C(O)(C(C=O)CC(=O)[O-])C(C)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C14H24N2O8/c1-3-16(4-5-17)7-11(19)15-14(24,9(2)13(22)23)10(8-18)6-12(20)21/h8-10,17,24H,3-7H2,1-2H3,(H,15,19)(H,20,21)(H,22,23)/t9?,10?,14? SMILES (mnx) [CH3:1][CH2:3][N:16]([CH2:4][CH2:5][OH:17])[CH2:7][C:11](=[N:15][C:14]([CH:9]([CH3:2])[C:13](=[O:22])[OH:23])([CH:10]([CH2:6][C:12](=[O:20])[OH:21])[CH:8]=[O:18])[OH:24])[OH:19]

Parent-child relations graph

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