Metabolite

KNApSAcK Entry

id C00028741
Name Nummularine O / N-Desmethyljubanine B
CAS RN 107602-86-8
Standard InChI InChI=1S/C42H45N5O6/c1-43-33(24-28-12-6-3-7-13-28)40(49)46-35(26-30-16-10-5-11-17-30)42(51)47-23-21-37-38(47)41(50)45-34(25-29-14-8-4-9-15-29)39(48)44-22-20-31-27-32(53-37)18-19-36(31)52-2/h3-20,22,27,33-35,37-38,43H,21,23-26H2,1-2H3,(H,44,48)(H,45,50)(H,46,49)/b22-20+
Standard InChI (Main Layer) InChI=1S/C42H45N5O6/c1-43-33(24-28-12-6-3-7-13-28)40(49)46-35(26-30-16-10-5-11-17-30)42(51)47-23-21-37-38(47)41(50)45-34(25-29-14-8-4-9-15-29)39(48)44-22-20-31-27-32(53-37)18-19-36(31)52-2/h3-20,22,27,33-35,37-38,43H,21,23-26H2,1-2H3,(H,44,48)(H,45,50)(H,46,49)

Cluster

Phytochemical cluster
KCF-S cluster No. 1131

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
Rhamnaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Zizyphus nummularia 498071 Rhamnaceae rosids Viridiplantae