3-phenyllactate

Properties Image MNX_ID MNXM726664 reference chebi:8100 formula C9H9O3 global charge -1 mol weight 165.168 InChIKey VOXXWSYKYCBWHO-UHFFFAOYSA-M InChI InChI=1S/C9H10O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/p-1 SMILES O=C([O-])C(O)CC1=CC=CC=C1 MNX internals InChI (mnx) InChI=1/C9H10O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/t8? SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:7]([CH2:6][CH:8]([C:9](=[O:11])[OH:12])[OH:10])[CH:5]=[CH:3]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 5