Fusarin a
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Formula: C23H29NO6
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Molecular weight: 415.50
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Smiles: CC=C(C=C(C)C=C(C)C=CC=C(C)C(=O)C1C2C(CCO2)(NC1=O)O)C(=O)OC
Fusarin a
Names
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Mycotoxin name: Fusarin a
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First synonym: None
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Synonyms: 100079-50-3,Fusarin A,methyl (2E,3E,5E,7E,9E)-11-[(3aS,6S,6aR)-3a-hydroxy-5-oxo-3,4,6,6a-tetrahydro-2H-furo[3,2-b]pyrrol-6-yl]-2-ethylidene-4,6,10-trimethyl-11-oxoundeca-3,5,7,9-tetraenoate,3,5,7,9-Undecatetraenoic acid, 2-ethylidene-11-(hexahydro-3a-hydroxy-5-oxo-2H-furo(3,2-b)pyrrol-6-yl)-4,6,10-trimethyl-11-oxo-, methyl ester, (3aS-(3aalpha,6alpha(2E,3E,5E,7E,9E),6aalpha))-,Methyl 2-ethylidene-11-(hexahydro-3a-hydroxy-5-oxo-2H-furo(3,2-b)pyrrol-6-yl)-4,6,10-trimethyl-11-oxo-3,5,7,9-undecatetraenoate (3aS-(3aalpha,6alpha(2E,3E,5E,7E,9E),6aalpha))-,Methyl (2E,3E,5E,7E,9E)-2-ethylidene-11-((3aS,6S,6aR)-3a-hydroxy-5-oxohexahydro-2H-furo[3,2-b]pyrrol-6-yl)-4,6,10-trimethyl-11-oxoundeca-3,5,7,9-tetraenoate
Identifiers / External links
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CAS: 100079-50-3
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PubChem CID: 6442086
Structure
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Smiles: CC=C(C=C(C)C=C(C)C=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)\C(=O)[C@@H]1[C@@H]2[C@@](CCO2)(NC1=O)O)/C(=O)OC
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Inchi: InChI=1S/C23H29NO6/c1-6-17(22(27)29-5)13-15(3)12-14(2)8-7-9-16(4)19(25)18-20-23(28,10-11-30-20)24-21(18)26/h6-9,12-13,18,20,28H,10-11H2,1-5H3,(H,24,26)/b8-7+,14-12+,15-13+,16-9+,17-6+/t18-,20-,23+/m1/s1
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Inchikey: UOPODNWYGYPLAE-IOAWLMGGSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C23H29NO6
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Molecular weight: 415.50
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Monoisotopic mass: 415.19948764
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Fungi
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Fungi id Species