PCIDB

KNApSAcK Metabolite C00009294

Metabolite

KNApSAcK Entry

id C00009294
Name Epicatechin-(2beta->7,4beta->8)-epicatechin-(4beta->8)-epigallocatechin
CAS RN 130918-31-9
Standard InChI InChI=1S/C45H36O19/c46-17-9-24(52)32-30(10-17)63-45(16-2-4-20(48)23(51)8-16)44(60)37(32)35-31(64-45)13-26(54)34-36(39(59)41(62-43(34)35)14-1-3-19(47)22(50)5-14)33-25(53)12-21(49)18-11-29(57)40(61-42(18)33)15-6-27(55)38(58)28(56)7-15/h1-10,12-13,29,36-37,39-41,44,46-60H,11H2/t29-,36+,37-,39-,40-,41-,44-,45+/m1/s1
Standard InChI (Main Layer) InChI=1S/C45H36O19/c46-17-9-24(52)32-30(10-17)63-45(16-2-4-20(48)23(51)8-16)44(60)37(32)35-31(64-45)13-26(54)34-36(39(59)41(62-43(34)35)14-1-3-19(47)22(50)5-14)33-25(53)12-21(49)18-11-29(57)40(61-42(18)33)15-6-27(55)38(58)28(56)7-15/h1-10,12-13,29,36-37,39-41,44,46-60H,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
Euphyllophyta 1

Family

family name count
Gleicheniaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Dicranopteris pedata 397678 Gleicheniaceae Euphyllophyta Viridiplantae