PCIDB

KNApSAcK Metabolite C00006862

Metabolite

KNApSAcK Entry

id C00006862
Name Peonidin 3-(6''-caffeylgucoside)
CAS RN 164584-53-6 / 68795-38-0
Standard InChI InChI=1S/C31H28O14/c1-41-23-9-15(4-6-19(23)34)30-24(12-17-20(35)10-16(32)11-22(17)43-30)44-31-29(40)28(39)27(38)25(45-31)13-42-26(37)7-3-14-2-5-18(33)21(36)8-14/h2-12,25,27-29,31,38-40H,13H2,1H3,(H4-,32,33,34,35,36,37)/p+1/t25?,27-,28?,29?,31-/m1/s1
Standard InChI (Main Layer) InChI=1S/C31H28O14/c1-41-23-9-15(4-6-19(23)34)30-24(12-17-20(35)10-16(32)11-22(17)43-30)44-31-29(40)28(39)27(38)25(45-31)13-42-26(37)7-3-14-2-5-18(33)21(36)8-14/h2-12,25,27-29,31,38-40H,13H2,1H3,(H4-,32,33,34,35,36,37)

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 30

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 2

Family

family name count
Vitaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Vitis cinerea 226012 Vitaceae rosids Viridiplantae
Vitis vinifera 29760 Vitaceae rosids Viridiplantae