compound 0107131

Properties Image MNX_ID MNXM1181228 reference envipathM:...332471cc86a4 formula C12H23N2O7 global charge -1 mol weight 307.323 InChIKey QEONFTUQDFKQGA-UHFFFAOYSA-M InChI InChI=1S/C12H24N2O7/c1-5-14(8(3)16)6-9(17)13-12(21,7(2)15)11(4,20)10(18)19/h7-8,15-16,20-21H,5-6H2,1-4H3,(H,13,17)(H,18,19)/p-1 SMILES CCN(C/C(O)=N/C(O)(C(C)O)C(C)(O)C(=O)[O-])C(C)O MNX internals InChI (mnx) InChI=1/C12H24N2O7/c1-5-14(8(3)16)6-9(17)13-12(21,7(2)15)11(4,20)10(18)19/h7-8,15-16,20-21H,5-6H2,1-4H3,(H,13,17)(H,18,19)/t7?,8?,11?,12? SMILES (mnx) [CH3:1][CH2:5][N:14]([CH2:6][C:9](=[N:13][C:12]([CH:7]([CH3:2])[OH:15])([C:11]([CH3:4])([C:10](=[O:18])[OH:19])[OH:20])[OH:21])[OH:17])[CH:8]([CH3:3])[OH:16]

Parent-child relations graph

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