Flavipucine
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Formula: C12H15NO4
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Molecular weight: 237.25
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Smiles: CC1=CC(=O)C2(C(O2)C(=O)CC(C)C)C(=O)N1
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Type: Pyridine (alkaloid)
Flavipucine
Names
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Mycotoxin name: Flavipucine
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First synonym: None
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Synonyms: Flavipucine,38473-18-6,(2R,3R)-6-methyl-2-(3-methylbutanoyl)-1-oxa-7-azaspiro[2.5]oct-5-ene-4,8-dione,(2R,3R)-6-methyl-2-(3-methylbutanoyl)-1-oxa-7-azaspiro(2.5)oct-5-ene-4,8-dione,CHEMBL62236,6-Methyl-2-(3-methyl-1-oxobutyl)-1-oxa-5-azaspiro(2.5)oct-6-ene-4,8-dione
Identifiers / External links
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CAS: 38473-18-6
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PubChem CID: 10444160
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ChemSpiderID: 142251
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ChEMBL: CHEMBL62236
Structure
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Smiles: CC1=CC(=O)C2(C(O2)C(=O)CC(C)C)C(=O)N1
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Isomeric smiles: CC1=CC(=O)[C@]2([C@@H](O2)C(=O)CC(C)C)C(=O)N1
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Inchi: InChI=1S/C12H15NO4/c1-6(2)4-8(14)10-12(17-10)9(15)5-7(3)13-11(12)16/h5-6,10H,4H2,1-3H3,(H,13,16)/t10-,12-/m0/s1
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Inchikey: DWCXXICTUDDKTB-JQWIXIFHSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C12H15NO4
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Molecular weight: 237.25
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Monoisotopic mass: 237.10010796
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Fungi
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Fungi id Species 352 Cladobotryum rubrobrunnescens