PCIDB

KNApSAcK Metabolite C00023322

Metabolite

KNApSAcK Entry

id C00023322
Name Peregrinol (diterpene)
CAS RN 17140-23-7
Standard InChI InChI=1S/C20H36O2/c1-15(10-14-21)7-8-17-19(4)12-6-11-18(2,3)16(19)9-13-20(17,5)22/h10,16-17,21-22H,6-9,11-14H2,1-5H3/b15-10+/t16-,17+,19+,20-/m0/s1
Standard InChI (Main Layer) InChI=1S/C20H36O2/c1-15(10-14-21)7-8-17-19(4)12-6-11-18(2,3)16(19)9-13-20(17,5)22/h10,16-17,21-22H,6-9,11-14H2,1-5H3

Cluster

Phytochemical cluster No. 46
KCF-S cluster No. 118

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL589839 CHEMBL1644112

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Lamiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Marrubium peregrinum 53166 Lamiaceae asterids Viridiplantae