EUCANNABINOLIDE

Structure

2D structure of EUCANNABINOLIDE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 5281471

Names and identifiers

Name

EUCANNABINOLIDE

IUPAC name

(3aR,4R,6E,9S,10Z,11aR)-9-acetoxy-6,10-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl (E)-4-hydroxy-2-(hydroxymethyl)but-2-enoate

SMILES

C/C/1=C\C[C@@H](/C(=C\[C@@H]2[C@@H]([C@@H](C1)OC(=O)/C(=C/CO)/CO)C(=C)C(=O)O2)/C)OC(=O)C

General information

Molecular formula

C22H28O8

Molecular weight

420.46 g/mol

Monoisotopic mass

420.1784 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Eupatorium cannabinum L. subsp. cannabinum aerial parts -
No reference
Eupatorium cannabinum L. subsp. cannabinum flower -
Rucker, G., Schenkel, E.P., Manns, D., Mayer, R., Hausen, B.M., Heiden, K. (1997). Allergenic sesquiterpene lactones from Eupatorium cannabinum L. and Kaunia rufescens (Lund ex De Candolle). Nat Toxins, 5(6), 223-227 doi:10.1002/(sici)1522-7189(1997)5:6