PCIDB

KNApSAcK Metabolite C00034187

Metabolite

KNApSAcK Entry

id C00034187
Name Quinoasaponin 2
CAS RN 116107-22-3
Standard InChI InChI=1S/C48H78O19/c1-43(2)13-15-48(42(61)67-40-36(59)34(57)31(54)25(19-50)63-40)16-14-46(5)22(23(48)17-43)7-8-28-44(3)11-10-29(45(4,21-52)27(44)9-12-47(28,46)6)65-41-37(60)38(32(55)26(20-51)64-41)66-39-35(58)33(56)30(53)24(18-49)62-39/h7,23-41,49-60H,8-21H2,1-6H3/t23-,24+,25+,26+,27+,28+,29-,30-,31+,32+,33-,34-,35+,36+,37+,38-,39-,40+,41+,44-,45-,46+,47+,48-/m0/s1
Standard InChI (Main Layer) InChI=1S/C48H78O19/c1-43(2)13-15-48(42(61)67-40-36(59)34(57)31(54)25(19-50)63-40)16-14-46(5)22(23(48)17-43)7-8-28-44(3)11-10-29(45(4,21-52)27(44)9-12-47(28,46)6)65-41-37(60)38(32(55)26(20-51)64-41)66-39-35(58)33(56)30(53)24(18-49)62-39/h7,23-41,49-60H,8-21H2,1-6H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 9

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
Amaranthaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Chenopodium quinoa Wild. 3558 Amaranthaceae eudicotyledons Viridiplantae