compound 0237304

Properties Image MNX_ID MNXM1186240 reference envipathM:...c739f34022b1 formula C14H13N2O5 global charge -1 mol weight 289.267 InChIKey UQGDIKOFPRBIRC-UHFFFAOYSA-M InChI InChI=1S/C14H14N2O5/c1-2-7(11(17)14(20)21)10-8-5-3-4-6-9(8)15-12(18)13(19)16-10/h3-7,13,19H,2H2,1H3,(H,15,18)(H,20,21)/p-1 SMILES CCC(C(=O)C(=O)[O-])C1=NC(O)C(=O)NC2=C1C=CC=C2 MNX internals InChI (mnx) InChI=1/C14H14N2O5/c1-2-7(11(17)14(20)21)10-8-5-3-4-6-9(8)15-12(18)13(19)16-10/h3-7,13,19H,2H2,1H3,(H,15,18)(H,20,21)/t7?,13? SMILES (mnx) [CH3:1][CH2:2][CH:7]([C:10]1=[N:16][CH:13]([OH:19])[C:12]([OH:18])=[N:15][C:9]2=[CH:6][CH:4]=[CH:3][CH:5]=[C:8]21)[C:11]([C:14]([OH:20])=[O:21])=[O:17]

Parent-child relations graph

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