PCIDB

KNApSAcK Metabolite C00009353

Metabolite

KNApSAcK Entry

id C00009353
Name Epitheaflagallin 3-O-gallate
CAS RN 102067-92-5
Standard InChI InChI=1S/C27H20O13/c28-12-6-14(29)13-8-20(40-27(38)11-4-15(30)22(34)16(31)5-11)26(39-19(13)7-12)10-1-9-2-18(33)24(36)25(37)21(9)23(35)17(32)3-10/h1-7,20,26,28-31,33-34,36-37H,8H2,(H,32,35)/t20-,26-/m1/s1
Standard InChI (Main Layer) InChI=1S/C27H20O13/c28-12-6-14(29)13-8-20(40-27(38)11-4-15(30)22(34)16(31)5-11)26(39-19(13)7-12)10-1-9-2-18(33)24(36)25(37)21(9)23(35)17(32)3-10/h1-7,20,26,28-31,33-34,36-37H,8H2,(H,32,35)

Cluster

Phytochemical cluster
KCF-S cluster No. 1179

Link

ChEMBL

By standard InChI CHEMBL349707
By standard InChI Main Layer CHEMBL349707

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 2

Family

family name count
Theaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Camellia sinensis var. assamica 261999 Theaceae asterids Viridiplantae
Camellia sinensis var. viridis 4441 Theaceae asterids Viridiplantae