Asperpyrone d
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Formula: C31H24O10
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Molecular weight: 556.50
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Smiles: CC1=CC(=C2C(=CC3=CC(=O)C(=C(C3=C2O)OC)C4=C(C5=C(C6=C4C=C(C=C6OC)OC)OC(=CC5=O)C)O)O1)O
Asperpyrone d
Names
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Mycotoxin name: Asperpyrone d
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First synonym: Asperpyrone d
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Synonyms: Asperpyrone D,5,8-dihydroxy-7-(5-hydroxy-8,10-dimethoxy-2-methyl-4-oxo-benzo[h]chromen-6-yl)-6-methoxy-2-methyl-benzo[g]chromen-4-one
Identifiers / External links
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CAS: 927683-64-5
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PubChem CID: 135513373
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ChemSpiderID: 17267389
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ChEMBL: CHEMBL4874178
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Chemical Entities of Biological Interest (CHEBI): CHEBI:226100
Structure
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Smiles: CC1=CC(=C2C(=CC3=CC(=O)C(=C(C3=C2O)OC)C4=C(C5=C(C6=C4C=C(C=C6OC)OC)OC(=CC5=O)C)O)O1)O
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Isomeric smiles: CC1=CC(=C2C(=CC3=CC(=O)C(=C(C3=C2O)OC)C4=C(C5=C(C6=C4C=C(C=C6OC)OC)OC(=CC5=O)C)O)O1)O
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Inchi: InChI=1S/C31H24O10/c1-12-6-17(32)25-21(40-12)9-14-8-19(34)26(30(39-5)22(14)28(25)35)24-16-10-15(37-3)11-20(38-4)23(16)31-27(29(24)36)18(33)7-13(2)41-31/h6-11,32,35-36H,1-5H3
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Inchikey: FXSBCSVDVXVGNP-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C31H24O10
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Molecular weight: 556.50
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Monoisotopic mass: 556.13694696
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Fungi
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Fungi id Species 275 Aspergillus tubingensis