PCIDB

KNApSAcK Metabolite C00009246

Metabolite

KNApSAcK Entry

id C00009246
Name Epigallocatechin-(4beta->8)-epigallocatechin 3-O-(4-hydroxybenzoate)
CAS RN 173484-94-1
Standard InChI InChI=1S/C37H30O16/c38-16-3-1-13(2-4-16)37(50)52-27-11-18-19(40)12-21(42)29(36(18)53-34(27)14-5-22(43)31(47)23(44)6-14)30-28-20(41)9-17(39)10-26(28)51-35(33(30)49)15-7-24(45)32(48)25(46)8-15/h1-10,12,27,30,33-35,38-49H,11H2/t27-,30-,33+,34-,35-/m1/s1
Standard InChI (Main Layer) InChI=1S/C37H30O16/c38-16-3-1-13(2-4-16)37(50)52-27-11-18-19(40)12-21(42)29(36(18)53-34(27)14-5-22(43)31(47)23(44)6-14)30-28-20(41)9-17(39)10-26(28)51-35(33(30)49)15-7-24(45)32(48)25(46)8-15/h1-10,12,27,30,33-35,38-49H,11H2

Cluster

Phytochemical cluster No. 19
KCF-S cluster No. 29

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Fabaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Stryphnodendron adstringens 397648 Fabaceae rosids Viridiplantae