PCIDB

KNApSAcK Metabolite C00048112

Metabolite

KNApSAcK Entry

id C00048112
Name Sculponin J / (-)-Sculponin J
CAS RN 1182713-64-9
Standard InChI InChI=1S/C20H26O7/c1-8-9-5-10(21)12-19(6-9,14(8)22)17(24)26-11-3-4-18(2)13-15(27-16(18)23)25-7-20(11,12)13/h9-16,21-23H,1,3-7H2,2H3/t9-,10-,11+,12-,13-,14-,15+,16+,18-,19+,20+/m1/s1
Standard InChI (Main Layer) InChI=1S/C20H26O7/c1-8-9-5-10(21)12-19(6-9,14(8)22)17(24)26-11-3-4-18(2)13-15(27-16(18)23)25-7-20(11,12)13/h9-16,21-23H,1,3-7H2,2H3

Cluster

Phytochemical cluster No. 41
KCF-S cluster No. 241

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1079901 CHEMBL1080243

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 sculponeatus 662928 Lamiaceae asterids Viridiplantae