Quinolactacide
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Formula: C14H8N2O2
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Molecular weight: 236.22
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Smiles: C1=CC=C2C(=C1)C(=O)C3=C(N2)C4=CC=CN4C3=O
Quinolactacide
Names
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Mycotoxin name: Quinolactacide
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First synonym: Quinolactacide
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Synonyms: QUINOLACTACIDE,CHEMBL2269361,DTXSID60467291,856216-29-0
Identifiers / External links
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CAS: 856216-29-0
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PubChem CID: 11481760
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DSS TOX CID: DTXCID90418110
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ChEMBL: CHEMBL2269361
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Chemical Entities of Biological Interest (CHEBI): CHEBI:224242
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CompTox Chemicals Dashboard (DTXSID): DTXSID60467291
Structure
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Smiles: C1=CC=C2C(=C1)C(=O)C3=C(N2)C4=CC=CN4C3=O
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Isomeric smiles: C1=CC=C2C(=C1)C(=O)C3=C(N2)C4=CC=CN4C3=O
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Inchi: InChI=1S/C14H8N2O2/c17-13-8-4-1-2-5-9(8)15-12-10-6-3-7-16(10)14(18)11(12)13/h1-7H,(H,15,17)
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Inchikey: QFTHRUCJNWMSRD-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C14H8N2O2
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Molecular weight: 236.22
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Monoisotopic mass: 236.058577502
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Fungi
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Fungi id Species 766 Penicillium citrinum