vanilpyruvic acid

Properties Image MNX_ID MNXM8118 reference chebi:88402 formula C10H10O5 global charge 0 mol weight 210.185 InChIKey YGQHQTMRZPHIBB-UHFFFAOYSA-N InChI InChI=1S/C10H10O5/c1-15-9-5-6(2-3-7(9)11)4-8(12)10(13)14/h2-3,5,11H,4H2,1H3,(H,13,14) SMILES COC1=C(O)C=CC(CC(=O)C(=O)O)=C1 MNX internals InChI (mnx) InChI=1/C10H10O5/c1-15-9-5-6(2-3-7(9)11)4-8(12)10(13)14/h2-3,5,11H,4H2,1H3,(H,13,14) SMILES (mnx) [CH3:1][O:15][C:9]1=[C:7]([OH:11])[CH:3]=[CH:2][C:6]([CH2:4][C:8]([C:10]([OH:13])=[O:14])=[O:12])=[CH:5]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 2