compound 0105855

Properties Image MNX_ID MNXM1181991 reference envipathM:...b5bba7b9e258 formula C8H15N2O6 global charge -1 mol weight 235.216 InChIKey HHRXSAJBXDYZSJ-UHFFFAOYSA-M InChI InChI=1S/C8H16N2O6/c1-2-8(16,10-5(12)3-9)7(15,4-11)6(13)14/h11,15-16H,2-4,9H2,1H3,(H,10,12)(H,13,14)/p-1 SMILES CCC(O)(/N=C(\O)CN)C(O)(CO)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C8H16N2O6/c1-2-8(16,10-5(12)3-9)7(15,4-11)6(13)14/h11,15-16H,2-4,9H2,1H3,(H,10,12)(H,13,14)/t7?,8? SMILES (mnx) [CH3:1][CH2:2][C:8]([C:7]([CH2:4][OH:11])([C:6](=[O:13])[OH:14])[OH:15])([N:10]=[C:5]([CH2:3][NH2:9])[OH:12])[OH:16]

Parent-child relations graph

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