PCIDB

KNApSAcK Metabolite C00044646

Metabolite

KNApSAcK Entry

id C00044646
Name Conyzasaponin P / (-)-Conyzasaponin P
CAS RN 653593-39-6
Standard InChI InChI=1S/C62H100O30/c1-25-43(87-49-39(74)35(70)29(67)19-81-49)45(89-54-47(78)62(80,23-65)24-84-54)42(77)51(85-25)90-46-37(72)31(69)21-83-53(46)92-55(79)61-14-12-56(2,3)16-27(61)26-8-9-34-57(4)17-28(66)48(58(5,22-64)33(57)10-11-60(34,7)59(26,6)13-15-61)91-52-41(76)44(38(73)32(18-63)86-52)88-50-40(75)36(71)30(68)20-82-50/h8,25,27-54,63-78,80H,9-24H2,1-7H3/t25-,27-,28-,29+,30+,31-,32+,33+,34+,35-,36-,37-,38+,39+,40+,41+,42+,43-,44-,45-,46+,47-,48-,49-,50-,51-,52-,53-,54-,57-,58-,59+,60+,61-,62+/m0/s1
Standard InChI (Main Layer) InChI=1S/C62H100O30/c1-25-43(87-49-39(74)35(70)29(67)19-81-49)45(89-54-47(78)62(80,23-65)24-84-54)42(77)51(85-25)90-46-37(72)31(69)21-83-53(46)92-55(79)61-14-12-56(2,3)16-27(61)26-8-9-34-57(4)17-28(66)48(58(5,22-64)33(57)10-11-60(34,7)59(26,6)13-15-61)91-52-41(76)44(38(73)32(18-63)86-52)88-50-40(75)36(71)30(68)20-82-50/h8,25,27-54,63-78,80H,9-24H2,1-7H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 4

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
Conyza blinii 1408201 Asteraceae asterids Viridiplantae