compound 0226496

Properties Image MNX_ID MNXM1178813 reference envipathM:...9351c52c45cf formula C11H9NO7 global charge -2 mol weight 267.193 InChIKey PGTVSAMDEOVEHV-UHFFFAOYSA-L InChI InChI=1S/C11H11NO7/c1-19-8(10(15)16)2-5-6(7(14)4-13)3-12-9(5)11(17)18/h3-4,8,12H,2H2,1H3,(H,15,16)(H,17,18)/p-2 SMILES COC(CC1=C(C(=O)[O-])NC=C1C(=O)C=O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C11H11NO7/c1-19-8(10(15)16)2-5-6(7(14)4-13)3-12-9(5)11(17)18/h3-4,8,12H,2H2,1H3,(H,15,16)(H,17,18)/t8? SMILES (mnx) [CH3:1][O:19][CH:8]([CH2:2][C:5]1=[C:9]([C:11](=[O:17])[OH:18])[NH:12][CH:3]=[C:6]1[C:7]([CH:4]=[O:13])=[O:14])[C:10](=[O:15])[OH:16]

Parent-child relations graph

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