PCIDB

KNApSAcK Metabolite C00005246

Metabolite

KNApSAcK Entry

id C00005246
Name Kaempferol 3-sophoroside-4'-glucoside
CAS RN 132923-22-9
Standard InChI InChI=1S/C33H40O21/c34-7-15-19(39)23(43)26(46)31(50-15)48-12-3-1-10(2-4-12)28-29(22(42)18-13(38)5-11(37)6-14(18)49-28)53-33-30(25(45)21(41)17(9-36)52-33)54-32-27(47)24(44)20(40)16(8-35)51-32/h1-6,15-17,19-21,23-27,30-41,43-47H,7-9H2/t15?,16?,17?,19-,20-,21-,23?,24?,25?,26-,27-,30?,31-,32+,33+/m1/s1
Standard InChI (Main Layer) InChI=1S/C33H40O21/c34-7-15-19(39)23(43)26(46)31(50-15)48-12-3-1-10(2-4-12)28-29(22(42)18-13(38)5-11(37)6-14(18)49-28)53-33-30(25(45)21(41)17(9-36)52-33)54-32-27(47)24(44)20(40)16(8-35)51-32/h1-6,15-17,19-21,23-27,30-41,43-47H,7-9H2

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
Euphyllophyta 1

Family

family name count
Aspleniaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Asplenium septentrionale 169380 Aspleniaceae Euphyllophyta Viridiplantae