Metabolite

KNApSAcK Entry

id C00012164
Name [3aS-(3aR*,4R*,5S*,6S*,10Z,11aS*)]-2,3,3a,4,5,6,7,11a-Octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-4-[(2-methyl-1-oxo-2-propenyl)oxy]-2,7-dioxo-6,9-epoxycyclodeca[b]furan-5-yl ester 3-methylbutanoic acid
CAS RN 71052-05-6
Standard InChI InChI=1S/C24H28O9/c1-11(2)7-18(27)31-22-21(32-23(29)12(3)4)20-15(19(28)13(5)30-20)8-14(10-25)16-9-17(26)24(22,6)33-16/h8-9,11,15,20-22,25H,3,5,7,10H2,1-2,4,6H3/b14-8-
Standard InChI (Main Layer) InChI=1S/C24H28O9/c1-11(2)7-18(27)31-22-21(32-23(29)12(3)4)20-15(19(28)13(5)30-20)8-14(10-25)16-9-17(26)24(22,6)33-16/h8-9,11,15,20-22,25H,3,5,7,10H2,1-2,4,6H3

Cluster

Phytochemical cluster
KCF-S cluster No. 7348

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
Calea urticifolia 183008 Asteraceae asterids Viridiplantae