PCIDB

KNApSAcK Metabolite C00038384

Metabolite

KNApSAcK Entry

id C00038384
Name Ageratoside C1 / (-)-Ageratoside C1
CAS RN 233761-50-7
Standard InChI InChI=1S/C41H62O16/c1-36(2)11-18-17-7-8-22-37(3)12-19(43)31(57-33-29(49)27(47)30(21(15-42)54-33)56-32-28(48)26(46)20(44)16-53-32)40(6,34(50)51)23(37)9-10-38(22,4)39(17,5)13-24(45)41(18)14-25(36)55-35(41)52/h7,18-33,42-49H,8-16H2,1-6H3,(H,50,51)/t18-,19-,20+,21+,22+,23+,24+,25-,26-,27+,28+,29+,30+,31-,32-,33-,37+,38+,39+,40-,41+/m0/s1
Standard InChI (Main Layer) InChI=1S/C41H62O16/c1-36(2)11-18-17-7-8-22-37(3)12-19(43)31(57-33-29(49)27(47)30(21(15-42)54-33)56-32-28(48)26(46)20(44)16-53-32)40(6,34(50)51)23(37)9-10-38(22,4)39(17,5)13-24(45)41(18)14-25(36)55-35(41)52/h7,18-33,42-49H,8-16H2,1-6H3,(H,50,51)

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
asterids 1

Family

family name count
Asteraceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Aster ageratoides Turez var. ovatus Nakai 41479 Asteraceae asterids Viridiplantae