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Penidienone

  • Formula: C14H18O

  • Molecular weight: 202.29

  • Smiles: CCCC=CC=CC1CC=CC(=O)C1=C

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Penidienone

Names
Structural Information
Physico-chemical Properties
ADME
Toxicity
Medical Chemistry
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Names

  • Mycotoxin name: Penidienone

  • First synonym: Penidienone

  • Synonyms: Penidienone,5-(1,3-Heptadienyl)-6-methylene-2-cyclohexene-1-one

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Structure

  • Smiles: CCCC=CC=CC1CC=CC(=O)C1=C

  • Isomeric smiles: CCC/C=C/C=C/C1CC=CC(=O)C1=C

  • Inchi: InChI=1S/C14H18O/c1-3-4-5-6-7-9-13-10-8-11-14(15)12(13)2/h5-9,11,13H,2-4,10H2,1H3/b6-5+,9-7+

  • Inchikey: JNFGTEZBSNFLIN-SBIWHPGTSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C14H18O

  • Molecular weight: 202.29

  • Monoisotopic mass: 202.135765193

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