input word = C00013274

Metabolite InformationStructural formula
Name Butiniflavan-(4beta->8)-epicatechin
(2S,2'R,3'R,4R)-2,2'-bis(3,4-Dihydroxyphenyl)-3,3',4,4'-tetrahydro-[4,8'-bi-2H-1-benzopyran]-3',5',7,7'-tetrol
Formula C30H26O10
Mw 546.15259705
CAS RN 254896-95-2
C_ID C00013274 ,
InChIKey PDKAXERKXHATQT-IJOOCHATNA-N
InChICode InChI=1S/C30H26O10/c31-15-3-4-16-17(11-26(39-27(16)9-15)13-1-5-19(32)22(35)7-13)28-24(37)12-21(34)18-10-25(38)29(40-30(18)28)14-2-6-20(33)23(36)8-14/h1-9,12,17,25-26,29,31-38H,10-11H2/t17-,25+,26+,29+/m1/s1
SMILES [C@@H]1(Oc2c([C@@H](C1)c1c3O[C@H]([C@H](Cc3c(cc1O)O)O)c1ccc(c(c1)O)O)ccc(c2)O)c1ccc(c(c1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCassia petersiana Ref.
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