compound 0075314

Properties Image MNX_ID MNXM1181323 reference envipathM:...be319236ac0a formula C14H14NO7 global charge -1 mol weight 308.266 InChIKey QXCXHQUDJQGFQY-UHFFFAOYSA-M InChI InChI=1S/C14H15NO7/c16-9-6-10(17)12(18)13(19)22-11(9)5-7-1-3-8(4-2-7)15-14(20)21/h1-4,10-12,15,17-18H,5-6H2,(H,20,21)/p-1 SMILES O=C([O-])NC1=CC=C(CC2OC(=O)C(O)C(O)CC2=O)C=C1 MNX internals InChI (mnx) InChI=1/C14H15NO7/c16-9-6-10(17)12(18)13(19)22-11(9)5-7-1-3-8(4-2-7)15-14(20)21/h1-4,10-12,15,17-18H,5-6H2,(H,20,21)/t10?,11?,12? SMILES (mnx) [CH:1]1=[CH:3][C:8]([NH:15][C:14](=[O:20])[OH:21])=[CH:4][CH:2]=[C:7]1[CH2:5][CH:11]1[C:9](=[O:16])[CH2:6][CH:10]([OH:17])[CH:12]([OH:18])[C:13](=[O:19])[O:22]1

Parent-child relations graph

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