Topopyrone c
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Formula: C18H10O7
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Molecular weight: 338.30
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Smiles: CC1=CC(=O)C2=C(C=C3C(=C2O1)C(=O)C4=C(C3=O)C=C(C=C4O)O)O
Topopyrone c
Names
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Mycotoxin name: Topopyrone c
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First synonym: Topopyrone c
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Synonyms: TOPOPYRONE C,CHEBI:66254,5,9,11-trihydroxy-2-methyl-4H-naphtho[2,3-h]chromene-4,7,12-trione,CHEMBL400146,SCHEMBL16226718,BDBM50378910,Q15427875
Identifiers / External links
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CAS: 308368-85-6
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PubChem CID: 9884262
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ChEMBL: CHEMBL400146,CHEMBL16226718
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Wikidata (wiki): Q15427875
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Chemical Entities of Biological Interest (CHEBI): CHEBI:66254
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CompTox Chemicals Dashboard (DTXSID): DTXSID701045476
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SCHEMBL: SCHEMBL16226718
Structure
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Smiles: CC1=CC(=O)C2=C(C=C3C(=C2O1)C(=O)C4=C(C3=O)C=C(C=C4O)O)O
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Isomeric smiles: CC1=CC(=O)C2=C(C=C3C(=C2O1)C(=O)C4=C(C3=O)C=C(C=C4O)O)O
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Inchi: InChI=1S/C18H10O7/c1-6-2-10(20)15-12(22)5-9-14(18(15)25-6)17(24)13-8(16(9)23)3-7(19)4-11(13)21/h2-5,19,21-22H,1H3
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Inchikey: AWDAPFGGFWZKGB-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C18H10O7
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Molecular weight: 338.30
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Monoisotopic mass: 338.04265265
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Fungi
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Fungi id Species 1035 Phoma sp. BAUA2861