ALPHA-IRONE

Structure

2D structure of ALPHA-IRONE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 5281521

Names and identifiers

Name

ALPHA-IRONE

IUPAC name

(E)-4-((1S,5R)-2,5,6,6-tetramethylcyclohex-2-en-1-yl)but-3-en-2-one

SMILES

C[C@@H]1CC=C([C@@H](C1(C)C)/C=C/C(=O)C)C

General information

Molecular formula

C14H22O

Molecular weight

206.33 g/mol

Monoisotopic mass

206.1671 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Iris germanica L. rhizome -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Viola odorata L. flower -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.