compound 0098560

Properties Image MNX_ID MNXM1189677 reference envipathM:...83e5c7fcc0be formula C12H16O3 global charge 0 mol weight 208.257 InChIKey ANXFKNKCKZMQFZ-UHFFFAOYSA-N InChI InChI=1S/C12H16O3/c1-8(2)9-5-4-6-10(11(9)14)12(3,15)7-13/h4-8,14-15H,1-3H3 SMILES CC(C)C1=CC=CC(C(C)(O)C=O)=C1O MNX internals InChI (mnx) InChI=1/C12H16O3/c1-8(2)9-5-4-6-10(11(9)14)12(3,15)7-13/h4-8,14-15H,1-3H3/t12? SMILES (mnx) [CH3:1][CH:8]([CH3:2])[C:9]1=[C:11]([OH:14])[C:10]([C:12]([CH3:3])([CH:7]=[O:13])[OH:15])=[CH:6][CH:4]=[CH:5]1

Parent-child relations graph

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