4-Hydroxy-2-oxo-5-methylhexanoate

Properties Image MNX_ID MNXM166372 reference sabiorkM:28354 formula C7H12O4 global charge 0 mol weight 160.169 InChIKey KOOZTYAWTLRMEF-UHFFFAOYSA-N InChI InChI=1S/C7H12O4/c1-4(2)5(8)3-6(9)7(10)11/h4-5,8H,3H2,1-2H3,(H,10,11) SMILES CC(C)C(O)CC(=O)C(=O)O MNX internals InChI (mnx) InChI=1/C7H12O4/c1-4(2)5(8)3-6(9)7(10)11/h4-5,8H,3H2,1-2H3,(H,10,11)/t5? SMILES (mnx) [CH3:1][CH:4]([CH3:2])[CH:5]([CH2:3][C:6]([C:7]([OH:10])=[O:11])=[O:9])[OH:8]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0