PCIDB

KNApSAcK Metabolite C00022746

Metabolite

KNApSAcK Entry

id C00022746
Name 19-Acetoxyvillenatriol / 19-Acetoxy-8(17),13E-labdadiene-7alpha,15-diol
CAS RN 66471-75-8
Standard InChI InChI=1S/C22H36O4/c1-15(9-12-23)7-8-18-16(2)19(25)13-20-21(4,14-26-17(3)24)10-6-11-22(18,20)5/h9,18-20,23,25H,2,6-8,10-14H2,1,3-5H3/b15-9+/t18-,19+,20?,21+,22+/m0/s1
Standard InChI (Main Layer) InChI=1S/C22H36O4/c1-15(9-12-23)7-8-18-16(2)19(25)13-20-21(4,14-26-17(3)24)10-6-11-22(18,20)5/h9,18-20,23,25H,2,6-8,10-14H2,1,3-5H3

Cluster

Phytochemical cluster
KCF-S cluster No. 318

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
Sideritis chamaedrifolia 155237 Lamiaceae asterids Viridiplantae