ANGELICOYLISOPETASOL

Structure

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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 5318627

ISOPETASIN

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

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

C₂₀H₂₈O₃

316.44 g/mol

316.2038 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	leaf	1500 ppm	Wichtl, M. 1984. Teedrogen. Ein Handbuch fur Apotheker und Arzte. Wissenschaftliche Verlagsgesellscharft. mbH Stuttgart. 393 pp.
Petasites hybridus (L.) G.Gaertn., B.Mey. & Scherb. subsp. hybridus	rhizome	-	Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Petasites hybridus (L.) G.Gaertn., B.Mey. & Scherb. subsp. hybridus	root	-	Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.

Plant	Plant part	Amount	Reference
Petasites hybridus (L.) G.Gaertn., B.Mey. & Scherb. subsp. hybridus	leaf	1500 ppm	Wichtl, M. 1984. Teedrogen. Ein Handbuch fur Apotheker und Arzte. Wissenschaftliche Verlagsgesellscharft. mbH Stuttgart. 393 pp.
Petasites hybridus (L.) G.Gaertn., B.Mey. & Scherb. subsp. hybridus	rhizome	-	Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Petasites hybridus (L.) G.Gaertn., B.Mey. & Scherb. subsp. hybridus	root	-	Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.