Lucilactaene
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Formula: C22H27NO6
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Molecular weight: 401.50
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Smiles: CC=C(C=C(C)C=CC=CC=C(C)C(=O)C1C2C(CCO2)(NC1=O)O)C(=O)OC
Lucilactaene
Names
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Mycotoxin name: Lucilactaene
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First synonym: Lucilactaene
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Synonyms: Lucilactaene
Identifiers / External links
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CAS: 386278-77-9
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PubChem CID: 9909017
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ChemSpiderID: 8084669
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ChEMBL: CHEMBL5072627
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Chemical Entities of Biological Interest (CHEBI): CHEBI:210751
Structure
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Smiles: CC=C(C=C(C)C=CC=CC=C(C)C(=O)C1C2C(CCO2)(NC1=O)O)C(=O)OC
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Isomeric smiles: C/C=C(\C=C(/C)\C=C\C=C\C=C(/C)\C(=O)[C@@H]1[C@@H]2[C@@](CCO2)(NC1=O)O)/C(=O)OC
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Inchi: InChI=1S/C22H27NO6/c1-5-16(21(26)28-4)13-14(2)9-7-6-8-10-15(3)18(24)17-19-22(27,11-12-29-19)23-20(17)25/h5-10,13,17,19,27H,11-12H2,1-4H3,(H,23,25)/b8-6+,9-7+,14-13+,15-10+,16-5+/t17-,19-,22+/m1/s1
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Inchikey: XJKYTYUOGYTPSB-HZDMFNNQSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C22H27NO6
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Molecular weight: 401.50
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Monoisotopic mass: 401.18383758
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Fungi
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Fungi id Species 572 Fusarium sp. RK97-94