Pyripyropene p
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Formula: C30H37NO7
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Molecular weight: 523.60
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Smiles: CCC(=O)OCC1(C2CCC3(C(C2(CCC1OC(=O)C)C)CC4=C(O3)C=C(OC4=O)C5=CN=CC=C5)C)C
Pyripyropene p
Names
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Mycotoxin name: Pyripyropene p
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First synonym: Pyripyropene p
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Synonyms: Pyripyropene P
Identifiers / External links
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CAS: 176385-05-0
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PubChem CID: 10792158
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Chemical Entities of Biological Interest (CHEBI): CHEBI:210970
Structure
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Smiles: CCC(=O)OCC1(C2CCC3(C(C2(CCC1OC(=O)C)C)CC4=C(O3)C=C(OC4=O)C5=CN=CC=C5)C)C
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Isomeric smiles: CCC(=O)OC[C@]1([C@@H]2CC[C@@]3([C@@H]([C@]2(CC[C@@H]1OC(=O)C)C)CC4=C(O3)C=C(OC4=O)C5=CN=CC=C5)C)C
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Inchi: InChI=1S/C30H37NO7/c1-6-26(33)35-17-29(4)23-9-12-30(5)24(28(23,3)11-10-25(29)36-18(2)32)14-20-22(38-30)15-21(37-27(20)34)19-8-7-13-31-16-19/h7-8,13,15-16,23-25H,6,9-12,14,17H2,1-5H3/t23-,24-,25+,28+,29+,30-/m1/s1
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Inchikey: DIVFNTZAITYKAW-ODNJFEEVSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C30H37NO7
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Molecular weight: 523.60
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Monoisotopic mass: 523.25700252
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Fungi
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Fungi id Species 141 Aspergillus fumigatus FO-1289-2501