compound 0109033

Properties Image MNX_ID MNXM1185654 reference envipathM:...97a58f34c8f1 formula C9H12N2O7 global charge -2 mol weight 260.202 InChIKey MJEGZSUMYQDXJR-UHFFFAOYSA-L InChI InChI=1S/C9H14N2O7/c1-3(6(13)8(15)16)5(7(14)9(17)18)11-4(12)2-10/h3,5,7,14H,2,10H2,1H3,(H,11,12)(H,15,16)(H,17,18)/p-2 SMILES CC(C(=O)C(=O)[O-])C(/N=C(\O)CN)C(O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C9H14N2O7/c1-3(6(13)8(15)16)5(7(14)9(17)18)11-4(12)2-10/h3,5,7,14H,2,10H2,1H3,(H,11,12)(H,15,16)(H,17,18)/t3?,5?,7? SMILES (mnx) [CH3:1][CH:3]([CH:5]([CH:7]([C:9](=[O:17])[OH:18])[OH:14])[N:11]=[C:4]([CH2:2][NH2:10])[OH:12])[C:6]([C:8]([OH:15])=[O:16])=[O:13]

Parent-child relations graph

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