Metabolite

KNApSAcK Entry

id C00020487
Name [3aS-(3aalpha,4alpha,5alpha,9aalpha,9bbeta)]-5-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-6-methyl-3,9-bis(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester 2-methylpropanoic acid
CAS RN 72635-04-2
Standard InChI InChI=1S/C21H24O6/c1-9(2)20(23)27-19-16-12(5)21(24)26-18(16)15-10(3)7-8-14(15)11(4)17(19)25-13(6)22/h7-9,15-19H,3,5H2,1-2,4,6H3/t15-,16-,17-,18+,19+/m0/s1
Standard InChI (Main Layer) InChI=1S/C21H24O6/c1-9(2)20(23)27-19-16-12(5)21(24)26-18(16)15-10(3)7-8-14(15)11(4)17(19)25-13(6)22/h7-9,15-19H,3,5H2,1-2,4,6H3

Cluster

Phytochemical cluster
KCF-S cluster No. 918

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
Athanasia montana 99033 Asteraceae asterids Viridiplantae