input word = C00008893

Metabolite InformationStructural formula
Name Epigallocatechin 5,3',5'-trimethyl ether 3-O-gallate
Formula C25H24O11
Mw 500.13186161
CAS RN 148707-36-2
C_ID C00008893 ,
InChIKey SMSODIBAMOCYJH-DCJNBRHWNA-N
InChICode InChI=1S/C25H24O11/c1-32-17-8-13(26)9-18-14(17)10-21(36-25(31)12-4-15(27)22(29)16(28)5-12)24(35-18)11-6-19(33-2)23(30)20(7-11)34-3/h4-9,21,24,26-30H,10H2,1-3H3/t21-,24-/m1/s1
SMILES COc1cc([C@H]2Oc3cc(O)cc(OC)c3C[C@H]2OC(=O)c2cc(O)c(O)c(O)c2)cc(OC)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCrassulaceaeSedum sediforme Ref.
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