feruloyl-beta-keto acid

Properties Image MNX_ID MNXM105128 reference chebi:71292 formula C12H11O5 global charge -1 mol weight 235.215 InChIKey CXMRDTYDEINMSY-UHFFFAOYSA-M InChI InChI=1S/C12H12O5/c1-17-11-6-8(3-5-10(11)14)2-4-9(13)7-12(15)16/h2-6,14H,7H2,1H3,(H,15,16)/p-1 SMILES COC1=CC(C=CC(=O)CC(=O)[O-])=CC=C1O MNX internals InChI (mnx) InChI=1/C12H12O5/c1-17-11-6-8(3-5-10(11)14)2-4-9(13)7-12(15)16/h2-6,14H,7H2,1H3,(H,15,16)/b4-2? SMILES (mnx) [CH3:1][O:17][C:11]1=[C:10]([OH:14])[CH:5]=[CH:3][C:8]([CH:2]=[CH:4][C:9]([CH2:7][C:12](=[O:15])[OH:16])=[O:13])=[CH:6]1

Parent-child relations graph

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