PCIDB

KNApSAcK Metabolite C00036511

Metabolite

KNApSAcK Entry

id C00036511
Name 3,3',4-tri-O-Methylellagic acid 4'-O-beta-D-glucopyranoside
CAS RN 51768-14-0
Standard InChI InChI=1S/C23H22O13/c1-30-9-4-7-12-13-8(22(29)35-19(12)17(9)31-2)5-10(18(32-3)20(13)36-21(7)28)33-23-16(27)15(26)14(25)11(6-24)34-23/h4-5,11,14-16,23-27H,6H2,1-3H3/t11-,14-,15+,16-,23-/m1/s1
Standard InChI (Main Layer) InChI=1S/C23H22O13/c1-30-9-4-7-12-13-8(22(29)35-19(12)17(9)31-2)5-10(18(32-3)20(13)36-21(7)28)33-23-16(27)15(26)14(25)11(6-24)34-23/h4-5,11,14-16,23-27H,6H2,1-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1389

Link

ChEMBL

By standard InChI CHEMBL463271
By standard InChI Main Layer CHEMBL463271

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1
asterids 1

Family

family name count
Euphorbiaceae 1
Cornaceae 1

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Euphorbia sessiliflora Roxb. 3977 Euphorbiaceae rosids Viridiplantae
Nyssa sylvatica 4292 Cornaceae asterids Viridiplantae