De-o-methylsterigmatocystin
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Formula: C17H10O6
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Molecular weight: 310.26
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Smiles: C1=CC(=C2C(=C1)OC3=C(C2=O)C(=CC4=C3C5C=COC5O4)O)O
De-o-methylsterigmatocystin
Names
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Mycotoxin name: De-o-methylsterigmatocystin
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First synonym: De-o-methylsterigmatocystin
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Synonyms: De-O-methylsterigmatocystin,DTXSID60952793,CHEBI:174227,6,8-Dihydroxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one,11,15-dihydroxy-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1(12),2(9),4,10,14,16,18-heptaen-13-one
Identifiers / External links
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PubChem CID: 5486185
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ChemSpiderID: 4588891
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Chemical Entities of Biological Interest (CHEBI): CHEBI:174227
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CompTox Chemicals Dashboard (DTXSID): DTXSID60952793
Structure
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Smiles: C1=CC(=C2C(=C1)OC3=C(C2=O)C(=CC4=C3C5C=COC5O4)O)O
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Isomeric smiles: C1=CC(=C2C(=C1)OC3=C(C2=O)C(=CC4=C3C5C=COC5O4)O)O
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Inchi: InChI=1S/C17H10O6/c18-8-2-1-3-10-13(8)15(20)14-9(19)6-11-12(16(14)22-10)7-4-5-21-17(7)23-11/h1-7,17-19H
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Inchikey: RQQOEIJLJPCYJR-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C17H10O6
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Molecular weight: 310.26
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Monoisotopic mass: 310.04773803
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Fungi
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Fungi id Species 286 Aspergillus versicolor