PCIDB

KNApSAcK Metabolite C00006760

Metabolite

KNApSAcK Entry

id C00006760
Name Pelargonidin 3-(4'''-p-coumarylrutinoside)
CAS RN
Standard InChI InChI=1S/C36H36O16/c1-16-33(52-27(41)11-4-17-2-7-19(37)8-3-17)30(44)32(46)35(48-16)47-15-26-28(42)29(43)31(45)36(51-26)50-25-14-22-23(40)12-21(39)13-24(22)49-34(25)18-5-9-20(38)10-6-18/h2-14,16,26,28-33,35-36,42-46H,15H2,1H3,(H3-,37,38,39,40,41)/p+1/t16?,26?,28-,29?,30-,31?,32?,33+,35-,36-/m1/s1
Standard InChI (Main Layer) InChI=1S/C36H36O16/c1-16-33(52-27(41)11-4-17-2-7-19(37)8-3-17)30(44)32(46)35(48-16)47-15-26-28(42)29(43)31(45)36(51-26)50-25-14-22-23(40)12-21(39)13-24(22)49-34(25)18-5-9-20(38)10-6-18/h2-14,16,26,28-33,35-36,42-46H,15H2,1H3,(H3-,37,38,39,40,41)

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 7

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
eudicotyledons 1

Family

family name count
Caryophyllaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Silene dioica 39879 Caryophyllaceae eudicotyledons Viridiplantae