PCIDB

KNApSAcK Metabolite C00001760

Metabolite

KNApSAcK Entry

id C00001760
Name Quadrigemine A
CAS RN 69937-02-6
Standard InChI InChI=1S/C44H50N8/c1-49-23-19-41(27-11-5-7-17-33(27)45-37(41)49)29-13-9-15-31-35(29)47-39-43(31,21-25-51(39)3)44-22-26-52(4)40(44)48-36-30(14-10-16-32(36)44)42-20-24-50(2)38(42)46-34-18-8-6-12-28(34)42/h5-18,37-40,45-48H,19-26H2,1-4H3
Standard InChI (Main Layer) InChI=1S/C44H50N8/c1-49-23-19-41(27-11-5-7-17-33(27)45-37(41)49)29-13-9-15-31-35(29)47-39-43(31,21-25-51(39)3)44-22-26-52(4)40(44)48-36-30(14-10-16-32(36)44)42-20-24-50(2)38(42)46-34-18-8-6-12-28(34)42/h5-18,37-40,45-48H,19-26H2,1-4H3

Cluster

Phytochemical cluster No. 4
KCF-S cluster No. 1006

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C09234

CTD

By CAS RN C051765

Species

Summary

Plant class

class name count
asterids 2

Family

family name count
Rubiaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Hodgkinsonia frutescens 1277303 Rubiaceae asterids Viridiplantae
Psychotria forsteriana 1277318 Rubiaceae asterids Viridiplantae