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Acetophthalidin

  • Formula: C10H8O5

  • Molecular weight: 208.17

  • Smiles: CC(=O)C1C2=C(C(=CC(=C2)O)O)C(=O)O1

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Acetophthalidin

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

Names

  • Mycotoxin name: Acetophthalidin

  • First synonym: Acetophthalidin

  • Synonyms: Acetophthalidin,SCHEMBL3726209

Identifiers / External links

Structure

  • Smiles: CC(=O)C1C2=C(C(=CC(=C2)O)O)C(=O)O1

  • Isomeric smiles: CC(=O)C1C2=C(C(=CC(=C2)O)O)C(=O)O1

  • Inchi: InChI=1S/C10H8O5/c1-4(11)9-6-2-5(12)3-7(13)8(6)10(14)15-9/h2-3,9,12-13H,1H3

  • Inchikey: KLBSSFLIZVTENH-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C10H8O5

  • Molecular weight: 208.17

  • Monoisotopic mass: 208.03717335

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