PCIDB

KNApSAcK Metabolite C00035863

Metabolite

KNApSAcK Entry

id C00035863
Name Pentandroside B / (+)-Pentandroside B
CAS RN 811799-58-3
Standard InChI InChI=1S/C40H64O14/c1-19(16-41)6-9-27(44)20(2)31-29(15-26-24-8-7-22-14-23(43)10-12-39(22,4)25(24)11-13-40(26,31)5)52-37-35(49)36(28(45)17-51-37)54-38-34(48)33(47)32(46)30(53-38)18-50-21(3)42/h14,19-20,24-38,41,44-49H,6-13,15-18H2,1-5H3/t19-,20+,24+,25-,26-,27-,28+,29-,30+,31-,32+,33-,34+,35+,36-,37-,38-,39-,40-/m0/s1
Standard InChI (Main Layer) InChI=1S/C40H64O14/c1-19(16-41)6-9-27(44)20(2)31-29(15-26-24-8-7-22-14-23(43)10-12-39(22,4)25(24)11-13-40(26,31)5)52-37-35(49)36(28(45)17-51-37)54-38-34(48)33(47)32(46)30(53-38)18-50-21(3)42/h14,19-20,24-38,41,44-49H,6-13,15-18H2,1-5H3

Cluster

Phytochemical cluster
KCF-S cluster No. 182

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 1

Family

family name count
Zygophyllaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Tribulus pentandrus 43873 Zygophyllaceae rosids Viridiplantae