CIS-DEHYDROMATRICARIA-ESTER

Structure

2D structure of CIS-DEHYDROMATRICARIA-ESTER
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 5281146

Names and identifiers

Name

CIS-DEHYDROMATRICARIA-ESTER

Also reported as

TRANS-DEHYDROMATRICARIA-ESTER

IUPAC name

methyl (E)-deca-2-en-4,6,8-triynoate

SMILES

COC(=O)\C=C\C#CC#CC#CC

General information

Molecular formula

C11H8O2

Molecular weight

172.18 g/mol

Monoisotopic mass

172.0524 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Achillea millefolium L. subsp. millefolium leaf -
List, P.H. and Horhammer, L., Hager's Handbuch der Pharmazeutischen Praxis, Vols. 2-6, Springer-Verlag, Berlin, 1969-1979.
Artemisia vulgaris L. flower -
U.S. Department of Agriculture, Agricultural Research Service. Dr. Duke's Phytochemical and Ethnobotanical Databases. https://phytochem.nal.usda.gov/
Artemisia vulgaris L. root 1 ppm; 9-13 ppm
U.S. Department of Agriculture, Agricultural Research Service. Dr. Duke's Phytochemical and Ethnobotanical Databases. https://phytochem.nal.usda.gov/