6-methoxysterigmatocystin
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Formula: C19H14O7
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Molecular weight: 354.30
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Smiles: COC1=CC(=C2C(=C1)OC3=C4C5C=COC5OC4=CC(=C3C2=O)OC)O
6-methoxysterigmatocystin
Names
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Mycotoxin name: 6-methoxysterigmatocystin
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First synonym: Unii-ko81n7b0bx
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Synonyms: UNII-KO81N7B0BX,KO81N7B0BX,6-Methoxysterigmatocystin,59092-98-7,7H-Furo(3',2':4,5)furo(2,3-C)xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6,10-dimethoxy-, (3aR,12cs)-,7H-Furo(3',2':4,5)furo(2,3-C)xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6,10-dimethoxy-, (3ar-cis)-
Identifiers / External links
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CAS: 59092-98-7
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PubChem CID: 122706802
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ChemSpiderID: 58828278
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US FDA (UNII): UNII-KO81N7B0BX
Structure
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Smiles: COC1=CC(=C2C(=C1)OC3=C4C5C=COC5OC4=CC(=C3C2=O)OC)O
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Isomeric smiles: COC1=CC(=C2C(=C1)OC3=C4C5C=COC5OC4=CC(=C3C2=O)OC)O
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Inchi: InChI=1S/C19H14O7/c1-22-8-5-10(20)15-12(6-8)25-18-14-9-3-4-24-19(9)26-13(14)7-11(23-2)16(18)17(15)21/h3-7,9,19-20H,1-2H3
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Inchikey: YDESMWIPEGEBBK-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C19H14O7
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Molecular weight: 354.30
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Monoisotopic mass: 354.07395278
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Fungi
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Fungi id Species 286 Aspergillus versicolor