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Chaetoquadrin j

  • Formula: C22H20O8

  • Molecular weight: 412.40

  • Smiles: CC1CC2=C(C(=C(C(=C2C(=O)O1)O)C)O)C3=C(C=C4C(=C3O)C(=O)C=C(O4)C)OC

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Chaetoquadrin j

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

  • Mycotoxin name: Chaetoquadrin j

  • First synonym: Chaetoquadrin j

  • Synonyms: Chaetoquadrin J

Identifiers / External links

Structure

  • Smiles: CC1CC2=C(C(=C(C(=C2C(=O)O1)O)C)O)C3=C(C=C4C(=C3O)C(=O)C=C(O4)C)OC

  • Isomeric smiles: CC1CC2=C(C(=C(C(=C2C(=O)O1)O)C)O)C3=C(C=C4C(=C3O)C(=O)C=C(O4)C)OC

  • Inchi: InChI=1S/C22H20O8/c1-8-5-11-15(19(24)10(3)20(25)16(11)22(27)30-8)18-13(28-4)7-14-17(21(18)26)12(23)6-9(2)29-14/h6-8,24-26H,5H2,1-4H3

  • Inchikey: XKWIEXWSFDIVDM-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C22H20O8

  • Molecular weight: 412.40

  • Monoisotopic mass: 412.11581759

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