2',5-dihydroxy-6,7-methylenedioxyisoflavone
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Formula: C16H10O6
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Molecular weight: 298.25
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Smiles: C1OC2=C(O1)C(=C3C(=C2)OC=C(C3=O)C4=CC=CC=C4O)O
2',5-dihydroxy-6,7-methylenedioxyisoflavone
Names
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Mycotoxin name: 2',5-dihydroxy-6,7-methylenedioxyisoflavone
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First synonym: Irisone b
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Synonyms: Irisone B,5,2'-Dihydroxy-6,7-methylenedioxyisoflavone,97359-75-6,2',5-Dihydroxy-6,7-methylenedioxyisoflavone,CHEMBL443974,DTXSID30242895,LMPK12050366,NSC621635,AKOS032961815,NSC-621635,8H-1,3-Dioxolo(4,5-g)(1)benzopyran-8-one, 9-hydroxy-7-(2-hydroxyphenyl)-
Identifiers / External links
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CAS: 97359-75-6
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PubChem CID: 5387194
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DSS TOX CID: DTXCID60165386
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ChemSpiderID: 4533789
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ChEMBL: CHEMBL443974
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CompTox Chemicals Dashboard (DTXSID): DTXSID30242895
Structure
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Smiles: C1OC2=C(O1)C(=C3C(=C2)OC=C(C3=O)C4=CC=CC=C4O)O
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Isomeric smiles: C1OC2=C(O1)C(=C3C(=C2)OC=C(C3=O)C4=CC=CC=C4O)O
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Inchi: InChI=1S/C16H10O6/c17-10-4-2-1-3-8(10)9-6-20-11-5-12-16(22-7-21-12)15(19)13(11)14(9)18/h1-6,17,19H,7H2
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Inchikey: ITRQVDOUFMSYII-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C16H10O6
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Molecular weight: 298.25
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Monoisotopic mass: 298.04773803
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Fungi
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Fungi id Species 316 Cercospora beticola