input word = C00061767

Metabolite InformationStructural formula
Name (-)-Gallocatechin gallate
Formula C22H18O11
Mw 458.08491142
CAS RN 4233-96-9
C_ID C00061767
InChIKey WMBWREPUVVBILR-NQIIRXRSSA-N
InChICode InChI=1S/C22H18O11/c23-10-5-12(24)11-7-18(33-22(31)9-3-15(27)20(30)16(28)4-9)21(32-17(11)6-10)8-1-13(25)19(29)14(26)2-8/h1-6,18,21,23-30H,7H2/t18-,21+/m1/s1
SMILES O=C(OC1Cc2c(O)cc(O)cc2OC1c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeTheaceaeCamellia sinensis Ref.
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