PCIDB

KNApSAcK Metabolite C00045675

Metabolite

KNApSAcK Entry

id C00045675
Name Atratoglaucoside B / (-)-Atratoglaucoside B
CAS RN 346616-66-8
Standard InChI InChI=1S/C42H62O16/c1-19-33(43)27(47-6)16-30(51-19)56-35-20(2)52-31(17-28(35)48-7)57-36-21(3)53-40(34(44)37(36)49-8)54-23-13-14-41(4)22(15-23)9-10-24-26(41)12-11-25-32-29(55-38(24)45)18-50-42(32,5)58-39(25)46/h9,11,19-21,23-24,26-37,40,43-44H,10,12-18H2,1-8H3/b25-11-/t19-,20+,21-,23+,24-,26+,27+,28+,29-,30+,31+,32-,33-,34-,35-,36-,37-,40+,41+,42-/m1/s1
Standard InChI (Main Layer) InChI=1S/C42H62O16/c1-19-33(43)27(47-6)16-30(51-19)56-35-20(2)52-31(17-28(35)48-7)57-36-21(3)53-40(34(44)37(36)49-8)54-23-13-14-41(4)22(15-23)9-10-24-26(41)12-11-25-32-29(55-38(24)45)18-50-42(32,5)58-39(25)46/h9,11,19-21,23-24,26-37,40,43-44H,10,12-18H2,1-8H3

Cluster

Phytochemical cluster
KCF-S cluster No. 703

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL447384

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Apocynaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Cynanchum atratum 157443 Apocynaceae asterids Viridiplantae