PCIDB

KNApSAcK Metabolite C00048542

Metabolite

KNApSAcK Entry

id C00048542
Name Sinuolatin E / (-)-Sinuolatin E
CAS RN 1196974-06-7
Standard InChI InChI=1S/C22H28O7/c1-10-12-7-13(28-11(2)23)15-21(8-12,17(10)24)19(26)29-14-5-6-20(3,4)16-18(25)27-9-22(14,15)16/h12-16,18,25H,1,5-9H2,2-4H3/t12-,13-,14+,15-,16-,18-,21+,22+/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H28O7/c1-10-12-7-13(28-11(2)23)15-21(8-12,17(10)24)19(26)29-14-5-6-20(3,4)16-18(25)27-9-22(14,15)16/h12-16,18,25H,1,5-9H2,2-4H3

Cluster

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

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
Isodon sinuolata 204130 Lamiaceae asterids Viridiplantae