input word = C00009196

Metabolite InformationStructural formula
Name 5-O-beta-D-Glucopyranosyl luteoliflavan-(4->8)-eriodictyol-5-O-beta-D-glucopyranoside
Formula C42H44O21
Mw 884.23750847
CAS RN 103658-56-6
C_ID C00009196 ,
InChIKey XUDCUGTUOLYOQH-NZLPNJJCNA-N
InChICode InChI=1S/C42H44O21/c43-12-29-34(52)36(54)38(56)41(62-29)60-27-8-16(45)7-26-32(27)17(9-24(58-26)14-1-3-18(46)20(48)5-14)31-22(50)11-28(61-42-39(57)37(55)35(53)30(13-44)63-42)33-23(51)10-25(59-40(31)33)15-2-4-19(47)21(49)6-15/h1-8,11,17,24-25,29-30,34-39,41-50,52-57H,9-10,12-13H2/t17-,24-,25-,29+,30+,34+,35+,36-,37-,38+,39+,41+,42+/m0/s1
SMILES O=C1C[C@@H](c2ccc(O)c(O)c2)Oc2c1c(O[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1O)cc(O)c2C1C[C@@H](c2ccc(O)c(O)c2)Oc2cc(O)cc(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)c21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeSorghum vulgare Ref.
zoom in



OrganismSorghum vulgare
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 355,Flavans and proanthocyanidins

Gujer,Phytochem.,25,(1986),1431