kaempferol 3-O-[6-(4-coumaroyl)-beta-D-glucosyl-(1->2)-glucosyl-(1->2)-beta-D-glucoside

Properties Image Occurences in reactions MNX_ID MNXM168044 #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0 formula C42H46O23 charge 0 mass 918.24299 reference metacycM:CPD-8069 InChIKey LFLDSGWMOQHQIG-QSNQBEPESA-N InChI InChI=1S/C42H46O23/c43-13-23-29(51)34(56)39(41(60-23)63-37-31(53)27-21(48)11-20(47)12-22(27)59-36(37)17-4-8-19(46)9-5-17)65-42-38(33(55)28(50)24(14-44)61-42)64-40-35(57)32(54)30(52)25(62-40)15-58-26(49)10-3-16-1-6-18(45)7-2-16/h1-12,23-25,28-30,32-35,38-48,50-52,54-57H,13-15H2/b10-3+/t23-,24-,25-,28-,29-,30-,32+,33+,34+,35-,38-,39-,40+,41+,42+/m0/s1 SMILES O=C(/C=C/c1ccc(O)cc1)OC[C@@H]1O[C@H](O[C@@H]2[C@@H](O[C@@H]3[C@@H](Oc4c(-c5ccc(O)cc5)oc5cc(O)cc(O)c5c4=O)O[C@@H](CO)[C@H](O)[C@H]3O)O[C@@H](CO)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph