Asperpyrone c
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Formula: C32H26O10
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Molecular weight: 570.50
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Smiles: CC1=CC(=O)C2=C(O1)C=C3C=C(C(=C(C3=C2O)OC)C4=C(C5=C(C6=C4C=C(C=C6OC)OC)OC(=CC5=O)C)O)OC
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Type: Bis-naphthopyrone
Asperpyrone c
Names
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Mycotoxin name: Asperpyrone c
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First synonym: Asperpyrone c
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Synonyms: asperpyrone C,CHEMBL446958,CHEBI:133762,491869-00-2,5-hydroxy-7-(5-hydroxy-8,10-dimethoxy-2-methyl-4-oxo-4H-naphtho[1,2-b]pyran-6-yl)-6,8-dimethoxy-2-methyl-4H-naphtho[2,3-b]pyran-4-one
Identifiers / External links
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CAS: 491869-00-2
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PubChem CID: 10995389
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ChemSpiderID: 9170584
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ChEMBL: CHEMBL446958
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Chemical Entities of Biological Interest (CHEBI): CHEBI:133762
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CompTox Chemicals Dashboard (DTXSID): DTXSID801101372
Structure
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Smiles: CC1=CC(=O)C2=C(O1)C=C3C=C(C(=C(C3=C2O)OC)C4=C(C5=C(C6=C4C=C(C=C6OC)OC)OC(=CC5=O)C)O)OC
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Isomeric smiles: CC1=CC(=O)C2=C(O1)C=C3C=C(C(=C(C3=C2O)OC)C4=C(C5=C(C6=C4C=C(C=C6OC)OC)OC(=CC5=O)C)O)OC
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Inchi: InChI=1S/C32H26O10/c1-13-7-18(33)26-22(41-13)10-15-9-20(38-4)28(31(40-6)23(15)29(26)35)25-17-11-16(37-3)12-21(39-5)24(17)32-27(30(25)36)19(34)8-14(2)42-32/h7-12,35-36H,1-6H3
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Inchikey: YVLPJBAIVAPEFU-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C32H26O10
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Molecular weight: 570.50
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Monoisotopic mass: 570.15259702
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Fungi
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Fungi id Species 176 Aspergillus niger 185 Aspergillus niger JV33-48 275 Aspergillus tubingensis