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Aspertoxin

  • Formula: C19H14O7

  • Molecular weight: 354.30

  • Smiles: COC1=CC=CC2=C1C(=O)C3=C(C=C4C(=C3O2)C5(C=COC5O4)O)OC

  • Type: Aflatoxin

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Aspertoxin

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

Names

  • Mycotoxin name: Aspertoxin

  • First synonym: Aspertoxin

  • Synonyms: Aspertoxin,20797-80-2,12c-Hydroxy-6,8-dimethoxy-3a,12c-dihydro-7H-furo(3',2':4,5)furo(2,3-c)xanthen-7-one,3-hydroxy-11,15-dimethoxy-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1,4,9,11,14(19),15,17-heptaen-13-one,HOMST,12c-Hydroxy-6,8-dimethoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one,1-Hydroxy-O-methylsterigmatocystin,DTXSID60943005,12c-Hydroxy-6,8-dimethoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one #,7H-Furo[3',2':4,5]furo[2,3-c]xanthen-7-one, 3a,12c-dihydro-12c-hydroxy-6,8-dimethoxy-,7H-Furo(3',2':4,5)furo(2,3-c)xanthen-7-one, 3a,12c-dihydro-12c-hydroxy-6,8-dimethoxy- (VAN)

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Structure

  • Smiles: COC1=CC=CC2=C1C(=O)C3=C(C=C4C(=C3O2)C5(C=COC5O4)O)OC

  • Isomeric smiles: COC1=CC=CC2=C1C(=O)C3=C(C=C4C(=C3O2)C5(C=COC5O4)O)OC

  • Inchi: InChI=1S/C19H14O7/c1-22-9-4-3-5-10-13(9)16(20)14-11(23-2)8-12-15(17(14)25-10)19(21)6-7-24-18(19)26-12/h3-8,18,21H,1-2H3

  • Inchikey: QRARGUIFAGCOOA-UHFFFAOYSA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C19H14O7

  • Molecular weight: 354.30

  • Monoisotopic mass: 354.07395278

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