compound 0100504

Properties Image MNX_ID MNXM1184209 reference envipathM:...4c9f6f733b34 formula C9H18N2O4 global charge 0 mol weight 218.253 InChIKey HAJLNHNUTWOORD-UHFFFAOYSA-N InChI InChI=1S/C9H18N2O4/c1-7(13)5-10-9(15)6-11(3-4-12)8(2)14/h8,12,14H,3-6H2,1-2H3,(H,10,15) SMILES CC(=O)C/N=C(\O)CN(CCO)C(C)O MNX internals InChI (mnx) InChI=1/C9H18N2O4/c1-7(13)5-10-9(15)6-11(3-4-12)8(2)14/h8,12,14H,3-6H2,1-2H3,(H,10,15)/t8? SMILES (mnx) [CH3:1][C:7]([CH2:5][N:10]=[C:9]([CH2:6][N:11]([CH2:3][CH2:4][OH:12])[CH:8]([CH3:2])[OH:14])[OH:15])=[O:13]

Parent-child relations graph

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