Asperflavin
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Formula: C16H16O5
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Molecular weight: 288.29
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Smiles: CC1(CC2=CC3=CC(=CC(=C3C(=C2C(=O)C1)O)OC)O)O
Asperflavin
Names
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Mycotoxin name: Asperflavin
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First synonym: Asperflavin
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Synonyms: Asperflavin,UNII-6E7PB8M04P,6E7PB8M04P,1415764-41-8,(3S)-3,6,9-trihydroxy-8-methoxy-3-methyl-2,4-dihydroanthracen-1-one,CHEMBL3358707,SCHEMBL16225648,ACon1_000647,NCGC00169497-01,BRD-K61109077-001-01-6,Q27264670,1(2H)-Anthracenone, 3,4-dihydro-3,6,9-trihydroxy-8-methoxy-3-methyl-, (3S)-
Identifiers / External links
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CAS: 1415764-41-8,38371-01-6,001-01-6
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PubChem CID: 14355112
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ChemSpiderID: 168155
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ChEMBL: CHEMBL16225648,CHEMBL3358707
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US FDA (UNII): UNII-6E7PB8M04P
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Wikidata (wiki): Q27264670
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SCHEMBL: SCHEMBL16225648
Structure
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Smiles: CC1(CC2=CC3=CC(=CC(=C3C(=C2C(=O)C1)O)OC)O)O
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Isomeric smiles: C[C@@]1(CC2=CC3=CC(=CC(=C3C(=C2C(=O)C1)O)OC)O)O
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Inchi: InChI=1S/C16H16O5/c1-16(20)6-9-3-8-4-10(17)5-12(21-2)14(8)15(19)13(9)11(18)7-16/h3-5,17,19-20H,6-7H2,1-2H3/t16-/m0/s1
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Inchikey: WCRDTBIKDNWXLR-INIZCTEOSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C16H16O5
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Molecular weight: 288.29
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Monoisotopic mass: 288.09977361
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Fungi
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Fungi id Species 125 Aspergillus flavus