input word = C00009128

Metabolite InformationStructural formula
Name Epiguibourtinidol-(4alpha->8)-epicatechin
Formula C30H26O10
Mw 546.15259705
CAS RN 123237-36-5
C_ID C00009128 ,
InChIKey JSHLJKSNROBZCN-HBSVGZFENA-N
InChICode InChI=1S/C30H26O10/c31-15-4-1-13(2-5-15)29-27(38)25(17-7-6-16(32)10-24(17)39-29)26-22(36)12-20(34)18-11-23(37)28(40-30(18)26)14-3-8-19(33)21(35)9-14/h1-10,12,23,25,27-29,31-38H,11H2/t23-,25+,27+,28-,29+/m0/s1
SMILES c12c([C@@H]([C@H]([C@H](O1)c1ccc(cc1)O)O)c1c3c(C[C@@H]([C@@H](O3)c3ccc(c(c3)O)O)O)c(cc1O)O)ccc(c2)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDalbergia monetaria Ref.
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