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Penicolinate C

  • Formula: C22H28N2O4

  • Molecular weight: 384.50

  • Smiles: COC(=O)C1=NC=C(C=C1)CCCCCCCCC2=CN=C(C=C2)C(=O)OC

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Penicolinate C

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

Names

  • Mycotoxin name: Penicolinate C

  • First synonym: None

  • Synonyms: Penicolinate C,methyl 5-[8-(6-methoxycarbonylpyridin-3-yl)octyl]pyridine-2-carboxylate,methyl 5-(8-(6-methoxycarbonylpyridin-3-yl)octyl)pyridine-2-carboxylate,CHEBI:200454

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Structure

  • Smiles: COC(=O)C1=NC=C(C=C1)CCCCCCCCC2=CN=C(C=C2)C(=O)OC

  • Isomeric smiles: COC(=O)C1=NC=C(C=C1)CCCCCCCCC2=CN=C(C=C2)C(=O)OC

  • Inchi: InChI=1S/C22H28N2O4/c1-27-21(25)19-13-11-17(15-23-19)9-7-5-3-4-6-8-10-18-12-14-20(24-16-18)22(26)28-2/h11-16H,3-10H2,1-2H3

  • Inchikey: JAANGLDOUAZYFO-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C22H28N2O4

  • Molecular weight: 384.50

  • Monoisotopic mass: 384.20490738

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Fungi

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