ISOPETASYL-ESTER-ISOBUTYRATE

Structure

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3D model

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

(1R,2R,8aR)-1,8a-dimethyl-6-oxo-7-(propan-2-ylidene)-1,2,3,4,6,7,8,8a-octahydronaphthalen-2-yl 2-methylbutanoate

CCC(C)C(=O)O[C@@H]2CCC1=CC(=O)C(=C(C)C)C[C@@]1([C@H]2C)C

C₂₀H₃₀O₃

318.46 g/mol

318.2195 Da

Pathway:

Superclass:

Class:

Glycoside:

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

Plant	Plant part	Amount	Reference
Petasites hybridus (L.) G.Gaertn., B.Mey. & Scherb. subsp. hybridus	-	-	J.S. Glasby Dict.Pls Containing 2ndary Metabolite. 1991.

Plant	Plant part	Amount	Reference
Petasites hybridus (L.) G.Gaertn., B.Mey. & Scherb. subsp. hybridus	-	-	J.S. Glasby Dict.Pls Containing 2ndary Metabolite. 1991.