ARCTIGNAN-B
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 71587385
Name
ARCTIGNAN-B
IUPAC name
2-oxo-2-(5'-(prop-1-yn-1-yl)-[2,2'-bithiophen]-5-yl)acetic acid
SMILES
CC#CC1=CC=C(S1)C2=CC=C(S2)C(=O)C(=O)O
Molecular formula
C13H8O3S2
Molecular weight
276.34 g/mol
Monoisotopic mass
275.9915 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Arctium lappa L. | fruit | 150 ppm |
Jim Duke's personal files.
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