CHAMAEPITIN
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Name
CHAMAEPITIN
IUPAC name
(1S,2S,3S,4aR,5S,6R,8S,8aR)-8-acetoxy-8a-(acetoxymethyl)-3-hydroxy-5-((2S,3aS,5S,6aR)-5-hydroxyhexahydrofuro[2,3-b]furan-2-yl)-5,6-dimethyloctahydro-2H-spiro[naphthalene-1,2'-oxiran]-2-yl (2S,3R)-3-acetoxy-2-methylbutanoate
SMILES
C([C@H]([C@@H](C)OC(=O)C)C)(=O)O[C@@H]1[C@@]2([C@@]3([C@H](C[C@H]([C@]([C@H]3C[C@@H]1O)(C)[C@@H]1C[C@@H]3[C@H](O1)O[C@@H](C3)O)C)OC(=O)C)COC(=O)C)OC2
Molecular formula
C31H46O13
Molecular weight
626.70 g/mol
Monoisotopic mass
626.2938 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Ajuga chamaepitys (L.) Schreb. | - | 200 ppm |
Jim Duke's personal files.
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