ISOPETASOSIDE
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Name
ISOPETASOSIDE
IUPAC name
4a,5-dimethyl-3-(propan-2-ylidene)-6-(((2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one
SMILES
CC1C(CCC2=CC(=O)C(=C(C)C)CC12C)O[C@@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)O
Molecular formula
C21H32O7
Molecular weight
396.48 g/mol
Monoisotopic mass
396.2148 Da
Pathway:
Superclass:
Class:
Glycoside:
Yes
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.
|