PCIDB

KNApSAcK Metabolite C00047256

Metabolite

KNApSAcK Entry

id C00047256
Name Isoscoparin H / (+)-Isoscoparin H
CAS RN 1097647-31-8
Standard InChI InChI=1S/C20H30O5/c1-10-11-7-12(22)15-19(3)6-4-5-18(2,9-21)13(19)8-14(23)20(15,16(10)24)17(11)25/h11,13-17,21,23-25H,1,4-9H2,2-3H3/t11?,13-,14-,15+,16-,17?,18-,19-,20-/m1/s1
Standard InChI (Main Layer) InChI=1S/C20H30O5/c1-10-11-7-12(22)15-19(3)6-4-5-18(2,9-21)13(19)8-14(23)20(15,16(10)24)17(11)25/h11,13-17,21,23-25H,1,4-9H2,2-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 132

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL551365

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
Isodon scoparius 662927 Lamiaceae asterids Viridiplantae