4-hydroxy-2-keto-5-methyl-6-oxo-3-hexenoate

Properties Image MNX_ID MNXM164298 reference metacycM:CPD-9159 formula C7H6O5 global charge -2 mol weight 170.12 InChIKey HUERLDOVKZMNGE-GORDUTHDSA-L InChI InChI=1S/C7H8O5/c1-4(3-8)5(9)2-6(10)7(11)12/h2-4,9H,1H3,(H,11,12)/p-2/b5-2+ SMILES CC(C=O)/C([O-])=C\C(=O)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C7H8O5/c1-4(3-8)5(9)2-6(10)7(11)12/h2-4,9H,1H3,(H,11,12)/b5-2+/t4? SMILES (mnx) [CH3:1][CH:4]([CH:3]=[O:8])/[C:5](=[CH:2]\[C:6]([C:7]([OH:11])=[O:12])=[O:10])[OH:9]

Parent-child relations graph

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