Farinosone b
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Formula: C25H27NO5
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Molecular weight: 421.50
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Smiles: CCC(C)C=C(C)C=CC=CC=CC(=O)C1=C(C(=CN(C1=O)O)C2=CC=C(C=C2)O)O
Farinosone b
Names
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Mycotoxin name: Farinosone b
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First synonym: Farinosone b
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Synonyms: FARINOSONE B,CHEMBL485463
Identifiers / External links
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CAS: 816431-94-4
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PubChem CID: 54677878
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ChemSpiderID: 24702722
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ChEMBL: CHEMBL485463
Structure
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Smiles: CCC(C)C=C(C)C=CC=CC=CC(=O)C1=C(C(=CN(C1=O)O)C2=CC=C(C=C2)O)O
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Isomeric smiles: CCC(C)/C=C(\C)/C=C/C=C/C=C/C(=O)C1=C(C(=CN(C1=O)O)C2=CC=C(C=C2)O)O
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Inchi: InChI=1S/C25H27NO5/c1-4-17(2)15-18(3)9-7-5-6-8-10-22(28)23-24(29)21(16-26(31)25(23)30)19-11-13-20(27)14-12-19/h5-17,27,29,31H,4H2,1-3H3/b6-5+,9-7+,10-8+,18-15+
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Inchikey: MBPKWWNMUUTTPP-PDOAJKQXSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C25H27NO5
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Molecular weight: 421.50
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Monoisotopic mass: 421.18892296
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Fungi
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Fungi id Species 708 Paecilomyces farinosus