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CHEBI:39836 - 2-(3,4-dihydroxyphenyl)-8-(1,1-dioxidoisothiazolidin-2-yl)-3-hydroxy-6-methyl-4H-chromen-4-one

ChEBI IDCHEBI:39836
ChEBI Name2-(3,4-dihydroxyphenyl)-8-(1,1-dioxidoisothiazolidin-2-yl)-3-hydroxy-6-methyl-4H-chromen-4-one
Stars
ASCII Name2-(3,4-dihydroxyphenyl)-8-(1,1-dioxidoisothiazolidin-2-yl)-3-hydroxy-6-methyl-4H-chromen-4-one
Last Modified17 October 2009
DownloadsMolfile
FormulaC19H17NO7S
Net Charge0
Average Mass403.412
Monoisotopic Mass403.07257
SMILES[H]Oc1c([H])c([H])c(-c2oc3c(N4C([H])([H])C([H])([H])C([H])([H])S4(=O)=O)c([H])c(C([H])([H])[H])c([H])c3c(=O)c2O[H])c([H])c1O[H]
InChIInChI=1S/C19H17NO7S/c1-10-7-12-16(23)17(24)18(11-3-4-14(21)15(22)9-11)27-19(12)13(8-10)20-5-2-6-28(20,25)26/h3-4,7-9,21-22,24H,2,5-6H2,1H3
InChIKeyCEXBEGBNDJVZPK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(3,4-dihydroxyphenyl)-8-(1,1-dioxidoisothiazolidin-2-yl)-3-hydroxy-6-methyl-4H-chromen-4-one (CHEBI:39836) is a sulfonamide (CHEBI:35358)
2-(3,4-dihydroxyphenyl)-8-(1,1-dioxidoisothiazolidin-2-yl)-3-hydroxy-6-methyl-4H-chromen-4-one (CHEBI:39836) is a thiazolidines (CHEBI:35622)
2-(3,4-dihydroxyphenyl)-8-(1,1-dioxidoisothiazolidin-2-yl)-3-hydroxy-6-methyl-4H-chromen-4-one (CHEBI:39836) is a trihydroxyflavone (CHEBI:27116)
Synonyms  Source
2-(3,4-DIHYDROXYPHENYL)-8-(1,1-DIOXIDOISOTHIAZOLIDIN-2-YL)-3-HYDROXY-6-METHYL-4H-CHROMEN-4-ONEPDBeChem
2-(3,4-dihydroxyphenyl)-8-(1,1-dioxidoisothiazolidin-2-yl)-3-hydroxy-6-methyl-4H-chromen-4-onePDBeChem
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