PCIDB

KNApSAcK Metabolite C00009234

Metabolite

KNApSAcK Entry

id C00009234
Name Epigallocatechin-(4beta->6)-epigallocatechin-3-O-gallate
CAS RN 159390-95-1
Standard InChI InChI=1S/C37H30O18/c38-14-7-16(39)27-25(8-14)54-36(12-3-20(43)32(49)21(44)4-12)34(51)29(27)28-17(40)10-24-15(30(28)47)9-26(35(53-24)11-1-18(41)31(48)19(42)2-11)55-37(52)13-5-22(45)33(50)23(46)6-13/h1-8,10,26,29,34-36,38-51H,9H2/t26-,29-,34-,35-,36?/m1/s1
Standard InChI (Main Layer) InChI=1S/C37H30O18/c38-14-7-16(39)27-25(8-14)54-36(12-3-20(43)32(49)21(44)4-12)34(51)29(27)28-17(40)10-24-15(30(28)47)9-26(35(53-24)11-1-18(41)31(48)19(42)2-11)55-37(52)13-5-22(45)33(50)23(46)6-13/h1-8,10,26,29,34-36,38-51H,9H2

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
Cistaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Cistus salviifolius 335170 Cistaceae rosids Viridiplantae