SULFORAPHENE

Structure

2D structure of SULFORAPHENE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 11620

Names and identifiers

Name

SULFORAPHENE

IUPAC name

(E)-4-isothiocyanato-1-(methylsulfinyl)but-1-ene

SMILES

CS(=O)C=CCCN=C=S

General information

Molecular formula

C6H9NOS2

Molecular weight

175.28 g/mol

Monoisotopic mass

175.0126 Da

Classification

Pathway:
Superclass:
-
Class:
-
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Plantago major L. - -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.