PCIDB

KNApSAcK Metabolite C00005488

Metabolite

KNApSAcK Entry

id C00005488
Name Quercetin 3-rutinoside-7,3'-diglucoside
CAS RN 75213-00-2
Standard InChI InChI=1S/C39H50O26/c1-10-21(44)26(49)30(53)36(58-10)57-9-19-24(47)29(52)33(56)39(64-19)65-35-25(48)20-14(43)5-12(59-37-31(54)27(50)22(45)17(7-40)62-37)6-16(20)60-34(35)11-2-3-13(42)15(4-11)61-38-32(55)28(51)23(46)18(8-41)63-38/h2-6,10,17-19,21-24,26-33,36-47,49-56H,7-9H2,1H3/t10?,17?,18?,19?,21-,22+,23+,24+,26-,27-,28-,29?,30?,31?,32?,33?,36+,37+,38+,39-/m0/s1
Standard InChI (Main Layer) InChI=1S/C39H50O26/c1-10-21(44)26(49)30(53)36(58-10)57-9-19-24(47)29(52)33(56)39(64-19)65-35-25(48)20-14(43)5-12(59-37-31(54)27(50)22(45)17(7-40)62-37)6-16(20)60-34(35)11-2-3-13(42)15(4-11)61-38-32(55)28(51)23(46)18(8-41)63-38/h2-6,10,17-19,21-24,26-33,36-47,49-56H,7-9H2,1H3

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
rosids 2

Family

family name count
Rosaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Prunus avium 42229 Rosaceae rosids Viridiplantae
Prunus cerasus 140311 Rosaceae rosids Viridiplantae