compound 0074120

Properties Image MNX_ID MNXM1138912 reference envipathM:...6bb90008493a formula C14H14NO8 global charge -1 mol weight 324.265 InChIKey VEIRFUUKWRJKCH-UHFFFAOYSA-M InChI InChI=1S/C14H15NO8/c16-6-15-8-3-1-7(2-4-8)5-9(11(18)13(20)21)10(17)12(19)14(22)23/h1-4,9-10,12,17-21H,5H2,(H,22,23)/p-1 SMILES O=C=NC1=CC=C(CC(C(O)=C(O)O)C(O)C(O)C(=O)[O-])C=C1 MNX internals InChI (mnx) InChI=1/C14H15NO8/c16-6-15-8-3-1-7(2-4-8)5-9(11(18)13(20)21)10(17)12(19)14(22)23/h1-4,9-10,12,17-21H,5H2,(H,22,23)/t9?,10?,12? SMILES (mnx) [CH:1]1=[CH:3][C:8]([N:15]=[C:6]=[O:16])=[CH:4][CH:2]=[C:7]1[CH2:5][CH:9]([CH:10]([CH:12]([C:14](=[O:22])[OH:23])[OH:19])[OH:17])[C:11](=[C:13]([OH:20])[OH:21])[OH:18]

Parent-child relations graph

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