4-(4-METHYL-PENT-3-ENYL)1,2-DITHIACYCLOHEX-4-ENE

Structure

2D structure of 4-(4-METHYL-PENT-3-ENYL)1,2-DITHIACYCLOHEX-4-ENE
2D structure
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3D model

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

Names and identifiers

Name

4-(4-METHYL-PENT-3-ENYL)1,2-DITHIACYCLOHEX-4-ENE

IUPAC name

(E)-4-(4-methylpent-2-en-1-yl)-3,6-dihydro-1,2-dithiine

SMILES

C1C=C(CSS1)CC=CC(C)C

General information

Molecular formula

C10H16S2

Molecular weight

200.37 g/mol

Monoisotopic mass

200.0693 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Humulus lupulus L. essential oil -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Rosa canina L. essential oil -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Rosa corymbifera Borkh. essential oil -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.