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Chaetoquadrin c

  • Formula: C20H24O6

  • Molecular weight: 360.40

  • Smiles: CC1CC(CC2(O1)C(CC3=C(C=C4C(=C3O2)C(=O)C=C(O4)C)OC)C)O

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Chaetoquadrin c

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

  • Mycotoxin name: Chaetoquadrin c

  • First synonym: Chaetoquadrin c

  • Synonyms: Chaetoquadrin C

Identifiers / External links

  • CAS: 457616-38-5

  • PubChem CID: 10247944

Structure

  • Smiles: CC1CC(CC2(O1)C(CC3=C(C=C4C(=C3O2)C(=O)C=C(O4)C)OC)C)O

  • Isomeric smiles: C[C@H]1C[C@@H](C[C@]2(O1)[C@H](CC3=C(C=C4C(=C3O2)C(=O)C=C(O4)C)OC)C)O

  • Inchi: InChI=1S/C20H24O6/c1-10-5-14-16(23-4)8-17-18(15(22)7-11(2)24-17)19(14)26-20(10)9-13(21)6-12(3)25-20/h7-8,10,12-13,21H,5-6,9H2,1-4H3/t10-,12-,13-,20+/m0/s1

  • Inchikey: MHQCFVVDBXCFCK-SGWVQJQLSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C20H24O6

  • Molecular weight: 360.40

  • Monoisotopic mass: 360.15728848

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