5-(4-METHYL-PENT-3-ENYL)-1,2,3-TRITHIACYCLOHEPT-5-ENE

Structure

2D structure of 5-(4-METHYL-PENT-3-ENYL)-1,2,3-TRITHIACYCLOHEPT-5-ENE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 131752315

Names and identifiers

Name

5-(4-METHYL-PENT-3-ENYL)-1,2,3-TRITHIACYCLOHEPT-5-ENE

IUPAC name

5-(4-methylpent-3-en-1-yl)-4,7-dihydro-1,2,3-trithiepine

SMILES

C1C=C(CSSS1)CCC=C(C)C

General information

Molecular formula

C10H16S3

Molecular weight

232.44 g/mol

Monoisotopic mass

232.0414 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.