Montadial A
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Formula: C12H12O4
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Molecular weight: 220.22
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Smiles: CC(=CCC1=C(C(=CC(=C1)C=O)O)O)C=O
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Type: Meroterpenoid
Montadial A
Names
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Mycotoxin name: Montadial A
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First synonym: None
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Synonyms: Montadial,MONTADIAL A,247132-16-7,3,4-dihydroxy-5-[(E)-3-methyl-4-oxobut-2-enyl]benzaldehyde,CHEMBL480468,DTXSID20434181,CHEBI:223244,NSC733438,NSC-733438
Identifiers / External links
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CAS: 247132-16-7
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PubChem CID: 10013724
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ChemSpiderID: 8189297
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ChEMBL: CHEMBL480468
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Chemical Entities of Biological Interest (CHEBI): CHEBI:223244
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CompTox Chemicals Dashboard (DTXSID): DTXSID20434181
Structure
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Smiles: CC(=CCC1=C(C(=CC(=C1)C=O)O)O)C=O
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Isomeric smiles: C/C(=C\CC1=C(C(=CC(=C1)C=O)O)O)/C=O
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Inchi: InChI=1S/C12H12O4/c1-8(6-13)2-3-10-4-9(7-14)5-11(15)12(10)16/h2,4-7,15-16H,3H2,1H3/b8-2+
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Inchikey: GYXDZVGSSXSODD-KRXBUXKQSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C12H12O4
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Molecular weight: 220.22
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Monoisotopic mass: 220.07355886
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Fungi
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Fungi id Species