Janoxepin
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Formula: C19H23N3O3
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Molecular weight: 341.40
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Smiles: CC(C)CC1C(=O)NC(=CC(C)C)C2=NC3=C(C=CC=CO3)C(=O)N12
Janoxepin
Names
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Mycotoxin name: Janoxepin
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First synonym: None
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Synonyms: Janoxepin,(4Z,7S)-7-(2-methylpropyl)-4-(2-methylpropylidene)-15-oxa-2,5,8-triazatricyclo[8.5.0.03,8]pentadeca-1(10),2,11,13-tetraene-6,9-dione,(4Z,7S)-7-(2-methylpropyl)-4-(2-methylpropylidene)-15-oxa-2,5,8-triazatricyclo(8.5.0.03,8)pentadeca-1(10),2,11,13-tetraene-6,9-dione,CHEBI:202534
Identifiers / External links
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PubChem CID: 11198626
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ChemSpiderID: 9373695
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Chemical Entities of Biological Interest (CHEBI): CHEBI:202534
Structure
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Smiles: CC(C)CC1C(=O)NC(=CC(C)C)C2=NC3=C(C=CC=CO3)C(=O)N12
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Isomeric smiles: CC(C)C[C@H]1C(=O)N/C(=C\C(C)C)/C2=NC3=C(C=CC=CO3)C(=O)N12
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Inchi: InChI=1S/C19H23N3O3/c1-11(2)9-14-16-21-18-13(7-5-6-8-25-18)19(24)22(16)15(10-12(3)4)17(23)20-14/h5-9,11-12,15H,10H2,1-4H3,(H,20,23)/b14-9-/t15-/m0/s1
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Inchikey: QPNGJZKIEDZQIV-MZLJFPOFSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C19H23N3O3
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Molecular weight: 341.40
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Monoisotopic mass: 341.1739416
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Fungi
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Fungi id Species 162 Aspergillus janus