Falconensin b
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Formula: C23H26Cl2O7
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Molecular weight: 485.30
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Smiles: CCCC1=CC2=CC(=O)C(C(C2CO1)O)(C)OC(=O)C3=C(C(=C(C(=C3OC)Cl)OC)Cl)C
Falconensin b
Names
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Mycotoxin name: Falconensin b
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First synonym: Falconensin b
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Synonyms: Falconensin B,C23H26Cl2O7
Identifiers / External links
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CAS: 147614-34-4
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PubChem CID: 10028332
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ChemSpiderID: 8203903
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Chemical Entities of Biological Interest (CHEBI): CHEBI:216171
Structure
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Smiles: CCCC1=CC2=CC(=O)C(C(C2CO1)O)(C)OC(=O)C3=C(C(=C(C(=C3OC)Cl)OC)Cl)C
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Isomeric smiles: CCCC1=CC2=CC(=O)[C@]([C@H]([C@@H]2CO1)O)(C)OC(=O)C3=C(C(=C(C(=C3OC)Cl)OC)Cl)C
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Inchi: InChI=1S/C23H26Cl2O7/c1-6-7-13-8-12-9-15(26)23(3,21(27)14(12)10-31-13)32-22(28)16-11(2)17(24)20(30-5)18(25)19(16)29-4/h8-9,14,21,27H,6-7,10H2,1-5H3/t14-,21+,23+/m1/s1
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Inchikey: CZHCYPZKAVRSGZ-ZGFCVWDJSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C23H26Cl2O7
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Molecular weight: 485.30
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Monoisotopic mass: 484.1055586
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Fungi
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Fungi id Species 461 Emericella falconensis