compound 0105728

Properties Image MNX_ID MNXM1184992 reference envipathM:...d57d72b50f2a formula C14H20N2O6 global charge 0 mol weight 312.322 InChIKey MHEIRBKODNZQRC-GIDUJCDVSA-N InChI InChI=1S/C14H20N2O6/c1-4-16(14(3,21)22)11(19)6-15-12-8(2)13(20)10(18)5-9(12)7-17/h5-7,11,18-22H,4H2,1-3H3/b15-6+ SMILES CCN(C(O)/C=N/C1=C(C=O)C=C(O)C(O)=C1C)C(C)(O)O MNX internals InChI (mnx) InChI=1/C14H20N2O6/c1-4-16(14(3,21)22)11(19)6-15-12-8(2)13(20)10(18)5-9(12)7-17/h5-7,11,18-22H,4H2,1-3H3/b15-6+/t11? SMILES (mnx) [CH3:1][CH2:4][N:16]([CH:11](/[CH:6]=[N:15]/[C:12]1=[C:8]([CH3:2])[C:13]([OH:20])=[C:10]([OH:18])[CH:5]=[C:9]1[CH:7]=[O:17])[OH:19])[C:14]([CH3:3])([OH:21])[OH:22]

Parent-child relations graph

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