4'-O-beta-D-glucosyl-cis-4-coumarate

Properties Image MNX_ID MNXM3857 reference chebi:47892 formula C15H17O8 global charge -1 mol weight 325.293 InChIKey LJFYQZQUAULRDF-LSSWKVNRSA-M InChI InChI=1S/C15H18O8/c16-7-10-12(19)13(20)14(21)15(23-10)22-9-4-1-8(2-5-9)3-6-11(17)18/h1-6,10,12-16,19-21H,7H2,(H,17,18)/p-1/b6-3-/t10-,12-,13+,14-,15-/m1/s1 SMILES O=C([O-])/C=C\C1=CC=C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1 MNX internals InChI (mnx) InChI=1/C15H18O8/c16-7-10-12(19)13(20)14(21)15(23-10)22-9-4-1-8(2-5-9)3-6-11(17)18/h1-6,10,12-16,19-21H,7H2,(H,17,18)/b6-3-/t10-,12-,13+,14-,15-/m1/s1 SMILES (mnx) [CH:1]1=[CH:4][C:9]([O:22][C@H:15]2[C@H:14]([OH:21])[C@@H:13]([OH:20])[C@H:12]([OH:19])[C@@H:10]([CH2:7][OH:16])[O:23]2)=[CH:5][CH:2]=[C:8]1/[CH:3]=[CH:6]\[C:11](=[O:17])[OH:18]

Parent-child relations graph

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