Frequentin
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Formula: C14H20O4
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Molecular weight: 252.31
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Smiles: CCCC=CC=CC1CC(C(C(=O)C1C=O)O)O
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Type: Cyclohexanecarbaldehyde23
Frequentin
Names
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Mycotoxin name: Frequentin
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First synonym: None
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Synonyms: Frequentin,29119-03-7,6-[(1E,3E)-hepta-1,3-dienyl]-3,4-dihydroxy-2-oxocyclohexane-1-carbaldehyde,6-(1,3-heptadien-1-yl)-3,4-dihydroxy-2-oxo-cyclohexanecarboxaldehyde,NSC246118,AKOS040748409,PD076129,HY-114881,CS-0064551,Cyclohexanecarboxaldehyde,3-heptadienyl)-3,4-dihydroxy-2-oxo- (VAN8C
Structure
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Smiles: CCCC=CC=CC1CC(C(C(=O)C1C=O)O)O
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Isomeric smiles: CCC/C=C/C=C/C1CC(C(C(=O)C1C=O)O)O
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Inchi: InChI=1S/C14H20O4/c1-2-3-4-5-6-7-10-8-12(16)14(18)13(17)11(10)9-15/h4-7,9-12,14,16,18H,2-3,8H2,1H3/b5-4+,7-6+
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Inchikey: MHZVWXOKIRZLCJ-YTXTXJHMSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C14H20O4
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Molecular weight: 252.31
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Monoisotopic mass: 252.13615911
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