PCIDB

KNApSAcK Metabolite C00045269

Metabolite

KNApSAcK Entry

id C00045269
Name Coleon U 11-acetate / (+)-Coleon U 11-acetate
CAS RN 328946-33-4
Standard InChI InChI=1S/C22H28O6/c1-10(2)12-15(24)13-14(19(17(12)26)28-11(3)23)22(6)9-7-8-21(4,5)20(22)18(27)16(13)25/h10,24,26-27H,7-9H2,1-6H3/t22-/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H28O6/c1-10(2)12-15(24)13-14(19(17(12)26)28-11(3)23)22(6)9-7-8-21(4,5)20(22)18(27)16(13)25/h10,24,26-27H,7-9H2,1-6H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1612

Link

ChEMBL

By standard InChI CHEMBL464030
By standard InChI Main Layer CHEMBL464030

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
Coleus xanthanthus 662900 Lamiaceae asterids Viridiplantae