Chaetoviridin a

  • Formula: C23H25ClO6

  • Molecular weight: 432.90

  • Smiles: CCC(C)C=CC1=CC2=C(C(=O)C3(C(=C(C(=O)O3)C(=O)C(C)C(C)O)C2=CO1)C)Cl

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Chaetoviridin a

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

Names

  • Mycotoxin name: Chaetoviridin a

  • First synonym: Chaetoviridin a

  • Synonyms: Chaetoviridin A, 128252-98-2, CHEBI:67610, (6aS)-5-chloro-9-[(2S,3R)-3-hydroxy-2-methylbutanoyl]-6a-methyl-3-[(E,3S)-3-methylpent-1-enyl]furo[2,3-h]isochromene-6,8-dione, CCRIS 7226, CHEMBL1802150, DTXSID80893270, (6aS)-5-chloro-9-[(2S,3R)-3-hydroxy-2-methylbutanoyl]-6a-methyl-3-[(1E,3S)-3-methylpent-1-en-1-yl]-6H-furo[2,3-h]isochromene-6,8(6aH)-dione, J-005582, Q27136080, (6aS)-5-chloro-9-[(2S,3R)-3-hydroxy-2-methyl-butanoyl]-6a-methyl-3-[(E,3S)-3-methylpent-1-enyl]furo[2,3-h]isochromene-6,8-dione, 1267888-95-8, 6H-Furo[2,3-h]-2-benzopyran-6,8(6aH)-dione, 5-chloro-9-[(2S,3R)-3-hydroxy-20methyl-1-oxobutyl]-6a-methyl-3-[(1E,3S)-3-methyl-1-pentenyl)-,(6aS)

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Structure

  • Smiles: CCC(C)C=CC1=CC2=C(C(=O)C3(C(=C(C(=O)O3)C(=O)C(C)C(C)O)C2=CO1)C)Cl

  • Isomeric smiles: CC[C@H](C)/C=C/C1=CC2=C(C(=O)[C@@]3(C(=C(C(=O)O3)C(=O)[C@@H](C)[C@@H](C)O)C2=CO1)C)Cl

  • Inchi: InChI=1S/C23H25ClO6/c1-6-11(2)7-8-14-9-15-16(10-29-14)18-17(20(26)12(3)13(4)25)22(28)30-23(18,5)21(27)19(15)24/h7-13,25H,6H2,1-5H3/b8-7+/t11-,12-,13+,23-/m0/s1

  • Inchikey: HWSQVPGTQUYLEQ-CCBHEJLASA-N

  • 2D structure:

  • 3D structure:

Physico-chemical properties

  • Formula: C23H25ClO6

  • Molecular weight: 432.90

  • Monoisotopic mass: 432.1339662

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