PCIDB

KNApSAcK Metabolite C00026417

Metabolite

KNApSAcK Entry

id C00026417
Name Hydrocupreine / Dihydrocupreine / 10,11-Dihydrocupreine / O6'-Demethylhydroquinine / 6'-Hydroxydihydrocinchonidine
CAS RN 5962-19-6
Standard InChI InChI=1S/C19H24N2O2/c1-2-12-11-21-8-6-13(12)9-18(21)19(23)15-5-7-20-17-4-3-14(22)10-16(15)17/h3-5,7,10,12-13,18-19,22-23H,2,6,8-9,11H2,1H3/t12-,13-,18-,19+/m0/s1
Standard InChI (Main Layer) InChI=1S/C19H24N2O2/c1-2-12-11-21-8-6-13(12)9-18(21)19(23)15-5-7-20-17-4-3-14(22)10-16(15)17/h3-5,7,10,12-13,18-19,22-23H,2,6,8-9,11H2,1H3

Cluster

Phytochemical cluster No. 7
KCF-S cluster No. 1378

Link

ChEMBL

By standard InChI CHEMBL532678
By standard InChI Main Layer CHEMBL532678 CHEMBL587165

KEGG

By LinkDB

CTD

By CAS RN C029820

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Rubiaceae 1

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Guettarda noumeana 336042 Rubiaceae asterids Viridiplantae
Timonius kaniensis