PCIDB

KNApSAcK Metabolite C00006677

Metabolite

KNApSAcK Entry

id C00006677
Name Cyanidin 3-rutinoside-5,3'-diglucoside
CAS RN
Standard InChI InChI=1S/C39H50O25/c1-11-23(44)27(48)31(52)36(57-11)56-10-22-26(47)30(51)34(55)39(64-22)61-19-7-14-16(5-13(42)6-17(14)59-37-32(53)28(49)24(45)20(8-40)62-37)58-35(19)12-2-3-15(43)18(4-12)60-38-33(54)29(50)25(46)21(9-41)63-38/h2-7,11,20-34,36-41,44-55H,8-10H2,1H3,(H-,42,43)/p+1/t11?,20?,21?,22?,23-,24+,25+,26+,27-,28-,29-,30?,31?,32?,33?,34?,36+,37+,38+,39+/m0/s1
Standard InChI (Main Layer) InChI=1S/C39H50O25/c1-11-23(44)27(48)31(52)36(57-11)56-10-22-26(47)30(51)34(55)39(64-22)61-19-7-14-16(5-13(42)6-17(14)59-37-32(53)28(49)24(45)20(8-40)62-37)58-35(19)12-2-3-15(43)18(4-12)60-38-33(54)29(50)25(46)21(9-41)63-38/h2-7,11,20-34,36-41,44-55H,8-10H2,1H3,(H-,42,43)

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 5

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
Liliopsida 1

Family

family name count
Bromeliaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Billbergia buchholtzii 15119 Bromeliaceae Liliopsida Viridiplantae