Metabolite

KNApSAcK Entry

id C00022564
Name 3alpha-Acetoxy-4beta,10beta-dihydroxy-8beta,17,15,16-bis-epoxy-cis-clerodane-13(16),14-dien-20,12-olide
CAS RN 129349-88-8
Standard InChI InChI=1S/C22H28O8/c1-13(23)29-16-4-6-22(26)18(2,19(16,3)25)7-8-20(12-28-20)21(22)10-15(30-17(21)24)14-5-9-27-11-14/h5,9,11,15-16,25-26H,4,6-8,10,12H2,1-3H3/t15-,16-,18-,19+,20?,21-,22-/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H28O8/c1-13(23)29-16-4-6-22(26)18(2,19(16,3)25)7-8-20(12-28-20)21(22)10-15(30-17(21)24)14-5-9-27-11-14/h5,9,11,15-16,25-26H,4,6-8,10,12H2,1-3H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1077

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
Asteraceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Pteronia incana 72971 Asteraceae asterids Viridiplantae