Asperpyrone b
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Formula: C32H26O10
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Molecular weight: 570.50
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Smiles: CC1=CC(=O)C2=C(C=C3C=C(C(=C(C3=C2O1)OC)C4=C(C5=C(C6=C4C=C(C=C6OC)OC)OC(=CC5=O)C)O)OC)O
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Type: Bis-naphthopyrone
Asperpyrone b
Names
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Mycotoxin name: Asperpyrone b
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First synonym: Asperpyrone b
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Synonyms: Asperpyrone B,CHEMBL443184,CHEBI:133761,491868-99-6,5,5'-dihydroxy-8,8',10,10'-tetramethoxy-2,2'-dimethyl-4H,4'H-[6,9'-binaphtho[1,2-b]pyran]-4,4'-dione
Identifiers / External links
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CAS: 491868-99-6
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PubChem CID: 11114482
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ChemSpiderID: 9289615
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ChEMBL: CHEMBL443184
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Chemical Entities of Biological Interest (CHEBI): CHEBI:133761
Structure
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Smiles: CC1=CC(=O)C2=C(C=C3C=C(C(=C(C3=C2O1)OC)C4=C(C5=C(C6=C4C=C(C=C6OC)OC)OC(=CC5=O)C)O)OC)O
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Isomeric smiles: CC1=CC(=O)C2=C(C=C3C=C(C(=C(C3=C2O1)OC)C4=C(C5=C(C6=C4C=C(C=C6OC)OC)OC(=CC5=O)C)O)OC)O
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Inchi: InChI=1S/C32H26O10/c1-13-7-18(33)26-20(35)9-15-10-21(38-4)28(30(40-6)23(15)31(26)41-13)25-17-11-16(37-3)12-22(39-5)24(17)32-27(29(25)36)19(34)8-14(2)42-32/h7-12,35-36H,1-6H3
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Inchikey: ADLOVFYPOQTFMO-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