ARCTIGNAN-D
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 71587384
Name
ARCTIGNAN-D
IUPAC name
2-hydroxy-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(C(=O)O)O
Molecular formula
C13H10O3S2
Molecular weight
278.35 g/mol
Monoisotopic mass
278.0071 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Arctium lappa L. | fruit | 250 ppm |
Jim Duke's personal files.
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