PCIDB

KNApSAcK Metabolite C00023539

Metabolite

KNApSAcK Entry

id C00023539
Name Isofruticolone
CAS RN 67244-39-7
Standard InChI InChI=1S/C22H30O6/c1-14-10-18(25)22(13-27-15(2)23)19(17(24)5-8-21(22)12-28-21)20(14,3)7-4-16-6-9-26-11-16/h6,9,11,14,18-19,25H,4-5,7-8,10,12-13H2,1-3H3/t14-,18-,19-,20+,21-,22-/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H30O6/c1-14-10-18(25)22(13-27-15(2)23)19(17(24)5-8-21(22)12-28-21)20(14,3)7-4-16-6-9-26-11-16/h6,9,11,14,18-19,25H,4-5,7-8,10,12-13H2,1-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 417

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

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
Teucrium fruticans 28514 Lamiaceae asterids Viridiplantae