input word = C00009242

Metabolite InformationStructural formula
Name Fisetinidol-(4alpha->8)-catechin-3-O-gallate
Formula C37H30O15
Mw 714.15847029
CAS RN 117479-72-8
C_ID C00009242 ,
InChIKey UCQWKYTZHALURJ-LDKJTTQJNA-N
InChICode InChI=1S/C37H30O15/c38-17-3-4-18-28(11-17)50-35(15-2-6-21(40)24(43)8-15)33(48)30(18)31-25(44)13-22(41)19-12-29(51-37(49)16-9-26(45)32(47)27(46)10-16)34(52-36(19)31)14-1-5-20(39)23(42)7-14/h1-11,13,29-30,33-35,38-48H,12H2/t29-,30+,33+,34-,35-/m1/s1
SMILES c1(c(cc(c2c1O[C@@H]([C@@H](C2)OC(=O)c1cc(c(c(c1)O)O)O)c1ccc(c(c1)O)O)O)O)[C@@H]1c2ccc(cc2O[C@@H]([C@H]1O)c1ccc(c(c1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeBurkea africana Ref.
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