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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > carbohydrate acid derivative > glucosiduronic acid > 3,4,5-trihydroxy-6-/{[5,6,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4h-chromen-3-yl]oxy/}oxane-2-carboxylic acid
... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > glycosiduronic acid > glucosiduronic acid > 3,4,5-trihydroxy-6-/{[5,6,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4h-chromen-3-yl]oxy/}oxane-2-carboxylic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > flavonoids > 3,4,5-trihydroxy-6-/{[5,6,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4h-chromen-3-yl]oxy/}oxane-2-carboxylic acid

Preferred term

3,4,5-trihydroxy-6-/{[5,6,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4h-chromen-3-yl]oxy/}oxane-2-carboxylic acid  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C22H20O14

inchi

  • InChI=1S/C22H20O14/c1-33-9-4-6(2-3-7(9)23)18-19(14(27)11-10(34-18)5-8(24)12(25)13(11)26)35-22-17(30)15(28)16(29)20(36-22)21(31)32/h2-5,15-17,20,22-26,28-30H,1H3,(H,31,32)

inchikey

  • KVEBZWYJDCRFCN-UHFFFAOYSA-N

mass

  • 508.388

monoisotopicmass

  • 508.08531

smiles

  • O1C(OC2=C(OC3=C(C2=O)C(O)=C(O)C(O)=C3)C4=CC(OC)=C(O)C=C4)C(O)C(O)C(O)C1C(O)=O

subset

  • 2_STAR

synonym EXACT

  • 3,4,5-trihydroxy-6-[5,6,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxyoxane-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:177972

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