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Chaetoquadrin d

  • Formula: C16H19NO7S

  • Molecular weight: 369.40

  • Smiles: CC1=CC(=O)C2=C(C(=C(C=C2O1)OC)CS(=O)(=O)CCNC(=O)C)O

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Chaetoquadrin d

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

  • Mycotoxin name: Chaetoquadrin d

  • First synonym: Chaetoquadrin d

  • Synonyms: Chaetoquadrin D

Identifiers / External links

Structure

  • Smiles: CC1=CC(=O)C2=C(C(=C(C=C2O1)OC)CS(=O)(=O)CCNC(=O)C)O

  • Isomeric smiles: CC1=CC(=O)C2=C(C(=C(C=C2O1)OC)CS(=O)(=O)CCNC(=O)C)O

  • Inchi: InChI=1S/C16H19NO7S/c1-9-6-12(19)15-14(24-9)7-13(23-3)11(16(15)20)8-25(21,22)5-4-17-10(2)18/h6-7,20H,4-5,8H2,1-3H3,(H,17,18)

  • Inchikey: OAZAJOMBGGJIBB-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C16H19NO7S

  • Molecular weight: 369.40

  • Monoisotopic mass: 369.08822312

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