compound 0100654

Properties Image MNX_ID MNXM1181392 reference envipathM:...c80ce1d26618 formula C8H12NO5 global charge -1 mol weight 202.186 InChIKey DTLZNYNICLWOLF-UHFFFAOYSA-M InChI InChI=1S/C8H13NO5/c1-4(8(13)14)7(5(2)11)9-6(12)3-10/h3-5,7,11H,1-2H3,(H,9,12)(H,13,14)/p-1 SMILES CC(O)C(/N=C(\O)C=O)C(C)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C8H13NO5/c1-4(8(13)14)7(5(2)11)9-6(12)3-10/h3-5,7,11H,1-2H3,(H,9,12)(H,13,14)/t4?,5?,7? SMILES (mnx) [CH3:1][CH:4]([CH:7]([CH:5]([CH3:2])[OH:11])[NH:9][C:6]([CH:3]=[O:10])=[O:12])[C:8](=[O:13])[OH:14]

Parent-child relations graph

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