PCIDB

KNApSAcK Metabolite C00008888

Metabolite

KNApSAcK Entry

id C00008888
Name Epigallocatechin 3,3',-di-O-gallate
CAS RN 89013-66-1
Standard InChI InChI=1S/C29H22O15/c30-13-7-15(31)14-9-23(44-29(41)12-4-18(34)25(38)19(35)5-12)27(42-21(14)8-13)10-1-20(36)26(39)22(6-10)43-28(40)11-2-16(32)24(37)17(33)3-11/h1-8,23,27,30-39H,9H2/t23-,27-/m1/s1
Standard InChI (Main Layer) InChI=1S/C29H22O15/c30-13-7-15(31)14-9-23(44-29(41)12-4-18(34)25(38)19(35)5-12)27(42-21(14)8-13)10-1-20(36)26(39)22(6-10)43-28(40)11-2-16(32)24(37)17(33)3-11/h1-8,23,27,30-39H,9H2

Cluster

Phytochemical cluster
KCF-S cluster No. 654

Link

ChEMBL

By standard InChI CHEMBL352134
By standard InChI Main Layer CHEMBL352134

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Theaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Camellia sinensis 4442 Theaceae asterids Viridiplantae