ARCTIC-ACID-B-METHYL-ESTER

Structure

2D structure of ARCTIC-ACID-B-METHYL-ESTER
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 85529415

Names and identifiers

Name

ARCTIC-ACID-B-METHYL-ESTER

IUPAC name

2-oxo-2-(5'-(prop-1-yn-1-yl)-[2,2'-bithiophen]-5-yl)ethyl acetate

SMILES

CC#CC1=CC=C(S1)C1=CC=C(S1)C(=O)COC(C)=O

General information

Molecular formula

C15H12O3S2

Molecular weight

304.39 g/mol

Monoisotopic mass

304.0228 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. root -
Jim Duke's personal files.