Asterriquinone SU 5500

  • Formula: C34H32N2O5

  • Molecular weight: 548.60

  • Smiles: CC(=CCC1=C(C2=CC=CC=C2N1)C3=C(C(=O)C(=C(C3=O)OC(=O)C)C4=C(NC5=CC=CC=C54)CC=C(C)C)O)C

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Asterriquinone SU 5500

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

Names

  • Mycotoxin name: Asterriquinone SU 5500

  • First synonym: None

  • Synonyms: Asterriquinone SU-5500,CHEBI:199489,[4-hydroxy-2,5-bis[2-(3-methylbut-2-enyl)-1H-indol-3-yl]-3,6-dioxocyclohexa-1,4-dien-1-yl] acetate

Identifiers / External links

Structure

  • Smiles: CC(=CCC1=C(C2=CC=CC=C2N1)C3=C(C(=O)C(=C(C3=O)OC(=O)C)C4=C(NC5=CC=CC=C54)CC=C(C)C)O)C

  • Isomeric smiles: CC(=CCC1=C(C2=CC=CC=C2N1)C3=C(C(=O)C(=C(C3=O)OC(=O)C)C4=C(NC5=CC=CC=C54)CC=C(C)C)O)C

  • Inchi: InChI=1S/C34H32N2O5/c1-18(2)14-16-25-27(21-10-6-8-12-23(21)35-25)29-31(38)32(39)30(34(33(29)40)41-20(5)37)28-22-11-7-9-13-24(22)36-26(28)17-15-19(3)4/h6-15,35-36,38H,16-17H2,1-5H3

  • Inchikey: GLHSYPGYNYXAQE-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C34H32N2O5

  • Molecular weight: 548.60

  • Monoisotopic mass: 548.23112213

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