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Concept information

... > organooxygen compound > carbonyl compound > ketone > cyclic ketone > isoflavones > 5,6,7,3',4'-pentahydroxyisoflavone
... > organooxygen compound > oxacycle > benzopyran > 1-benzopyran > isoflavonoid > isoflavones > 5,6,7,3',4'-pentahydroxyisoflavone

Preferred term

5,6,7,3',4'-pentahydroxyisoflavone  

Type

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

Broader concept

charge

  • 0

formula

  • C15H10O7

inchi

  • InChI=1S/C15H10O7/c16-8-2-1-6(3-9(8)17)7-5-22-11-4-10(18)14(20)15(21)12(11)13(7)19/h1-5,16-18,20-21H

inchikey

  • BIDDAFIPYBBDES-UHFFFAOYSA-N

mass

  • 302.238

monoisotopicmass

  • 302.04265

smiles

  • O1C2=C(C(=O)C(C3=CC(O)=C(O)C=C3)=C1)C(O)=C(O)C(O)=C2

subset

  • 2_STAR

synonym EXACT

  • 3-(3,4-dihydroxyphenyl)-5,6,7-trihydroxychromen-4-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:174880

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