Metabolite

KNApSAcK Entry

id C00035452
Name 1,2,4,6-Tetra-O-galloyl-beta-D-glucose
CAS RN 84297-49-4
Standard InChI InChI=1S/C34H28O22/c35-14-1-10(2-15(36)23(14)43)30(48)52-9-22-28(54-31(49)11-3-16(37)24(44)17(38)4-11)27(47)29(55-32(50)12-5-18(39)25(45)19(40)6-12)34(53-22)56-33(51)13-7-20(41)26(46)21(42)8-13/h1-8,22,27-29,34-47H,9H2/t22-,27+,28-,29-,34+/m1/s1
Standard InChI (Main Layer) InChI=1S/C34H28O22/c35-14-1-10(2-15(36)23(14)43)30(48)52-9-22-28(54-31(49)11-3-16(37)24(44)17(38)4-11)27(47)29(55-32(50)12-5-18(39)25(45)19(40)6-12)34(53-22)56-33(51)13-7-20(41)26(46)21(42)8-13/h1-8,22,27-29,34-47H,9H2

Cluster

Phytochemical cluster No. 81
KCF-S cluster No. 448

Link

ChEMBL

By standard InChI CHEMBL449495
By standard InChI Main Layer CHEMBL449495

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Melastomataceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Monochaetum multiflorum 113471 Melastomataceae rosids Viridiplantae