4-coumaroyl-4'-hydroxyphenyllactate

Properties Image MNX_ID MNXM8142 reference metacycM:CPD-6976 formula C18H15O6 global charge -1 mol weight 327.312 InChIKey LVPGCTXCBGXZHO-ZWIJEDICSA-M InChI InChI=1S/C18H16O6/c19-14-6-1-12(2-7-14)5-10-17(21)24-16(18(22)23)11-13-3-8-15(20)9-4-13/h1-10,16,19-20H,11H2,(H,22,23)/p-1/b10-5+/t16-/m1/s1 SMILES O=C(/C=C/C1=CC=C(O)C=C1)O[C@H](CC1=CC=C(O)C=C1)C(=O)[O-] MNX internals InChI (mnx) InChI=1/C18H16O6/c19-14-6-1-12(2-7-14)5-10-17(21)24-16(18(22)23)11-13-3-8-15(20)9-4-13/h1-10,16,19-20H,11H2,(H,22,23)/b10-5+/t16-/m1/s1 SMILES (mnx) [CH:1]1=[CH:6][C:14]([OH:19])=[CH:7][CH:2]=[C:12]1/[CH:5]=[CH:10]/[C:17](=[O:21])[O:24][C@H:16]([CH2:11][C:13]1=[CH:4][CH:9]=[C:15]([OH:20])[CH:8]=[CH:3]1)[C:18](=[O:22])[OH:23]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 7 in models (compartimentalized) 0