PCIDB

KNApSAcK Metabolite C00003447

Metabolite

KNApSAcK Entry

id C00003447
Name Jodrellin A
CAS RN 124901-80-0
Standard InChI InChI=1S/C22H30O6/c1-12-4-6-22-16(20(12,3)17-8-14-5-7-24-18(14)28-17)9-15(10-21(22)11-25-21)27-19(22)26-13(2)23/h5,7,12,14-19H,4,6,8-11H2,1-3H3/t12-,14-,15-,16-,17+,18+,19?,20+,21+,22-/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H30O6/c1-12-4-6-22-16(20(12,3)17-8-14-5-7-24-18(14)28-17)9-15(10-21(22)11-25-21)27-19(22)26-13(2)23/h5,7,12,14-19H,4,6,8-11H2,1-3H3

Cluster

Phytochemical cluster No. 41
KCF-S cluster No. 862

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C09121

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
Scutellaria woronowii 4139 Lamiaceae asterids Viridiplantae