Fellutanine b
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Formula: C27H28N4O2
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Molecular weight: 440.50
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Smiles: CC(C)(C=C)C1=C(C2=CC=CC=C2N1)CC3C(=O)NC(C(=O)N3)CC4=CNC5=CC=CC=C54
Fellutanine b
Names
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Mycotoxin name: Fellutanine b
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First synonym: Fellutanine b
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Synonyms: fellutanine B
Identifiers / External links
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CAS: 175522-05-1
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PubChem CID: 10646771
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ChemSpiderID: 22842431
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Chemical Entities of Biological Interest (CHEBI): CHEBI:221490
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CompTox Chemicals Dashboard (DTXSID): DTXSID901109400
Structure
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Smiles: CC(C)(C=C)C1=C(C2=CC=CC=C2N1)CC3C(=O)NC(C(=O)N3)CC4=CNC5=CC=CC=C54
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Isomeric smiles: CC(C)(C=C)C1=C(C2=CC=CC=C2N1)C[C@H]3C(=O)N[C@@H](C(=O)N3)CC4=CNC5=CC=CC=C54
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Inchi: InChI=1S/C27H28N4O2/c1-4-27(2,3)24-19(18-10-6-8-12-21(18)29-24)14-23-26(33)30-22(25(32)31-23)13-16-15-28-20-11-7-5-9-17(16)20/h4-12,15,22-23,28-29H,1,13-14H2,2-3H3,(H,30,33)(H,31,32)/t22-,23+/m1/s1
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Inchikey: PFYKDKMYQRWRGF-PKTZIBPZSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C27H28N4O2
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Molecular weight: 440.50
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Monoisotopic mass: 440.22122615
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Fungi
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Fungi id Species 804 Penicillium fellutanum