Logo Anses
Logo Interreg

Aspergione b

  • Formula: C15H16O4

  • Molecular weight: 260.28

  • Smiles: CC1CC2=C(C(O1)O)C3=C(C=C2)C(=O)C(=C(O3)C)C

Download

Aspergione b

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

Names

  • Mycotoxin name: Aspergione b

  • First synonym: Aspergione b

  • Synonyms: Aspergione B

Identifiers / External links

Structure

  • Smiles: CC1CC2=C(C(O1)O)C3=C(C=C2)C(=O)C(=C(O3)C)C

  • Isomeric smiles: CC1CC2=C(C(O1)O)C3=C(C=C2)C(=O)C(=C(O3)C)C

  • Inchi: InChI=1S/C15H16O4/c1-7-6-10-4-5-11-13(16)8(2)9(3)19-14(11)12(10)15(17)18-7/h4-5,7,15,17H,6H2,1-3H3

  • Inchikey: LKSUTKLZDIWZPN-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C15H16O4

  • Molecular weight: 260.28

  • Monoisotopic mass: 260.10485899

Select an endpoint:

Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Category Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Category Sub category Endpoint Tool QSAR ID Value Unit Comments Reference

Select an endpoint:

Endpoint Tool Value Unit Comments Reference

Fungi