ARCTINONE-ACETATE

Structure

2D structure of ARCTINONE-ACETATE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 13939273

Names and identifiers

Name

ARCTINONE-ACETATE

IUPAC name

(5'-(prop-1-yn-1-yl)-[2,2'-bithiophen]-5-yl)methanol

SMILES

CC#CC1=CC=C(S1)C2=CC=C(S2)CO

General information

Molecular formula

C12H10OS2

Molecular weight

234.35 g/mol

Monoisotopic mass

234.0173 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Arctium lappa L. - -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.