4-METHYL-MERCAPTO-DECA-CIS-2-CIS-4-DIEN-6,8-DIYNOIC-METHYL ESTER

Structure

2D structure of 4-METHYL-MERCAPTO-DECA-CIS-2-CIS-4-DIEN-6,8-DIYNOIC-METHYL ESTER
2D structure
Drag to rotate, scroll to zoom
3D model

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

Names and identifiers

Name

4-METHYL-MERCAPTO-DECA-CIS-2-CIS-4-DIEN-6,8-DIYNOIC-METHYL ESTER

IUPAC name

methyl (2Z,4Z)-4-(methylthio)deca-2,4-dien-6,8-diynoate

SMILES

CC#CC#C\C(=C(\C(=C(/C(=O)OC)[H])[H])SC)[H]

General information

Molecular formula

C12H12O2S

Molecular weight

220.29 g/mol

Monoisotopic mass

220.0558 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Cota tinctoria (L.) J.Gay subsp. australis (R.Fern.) Oberpr. & Greuter root -
Bohlmann, F., Kleine, K.M. (1966). Polyacetylene compounds. cvi. several new polyacetylene compounds from the genus Anthemis L. Chem Ber, 99, 2096-2103