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CHEBI:62734 - 2,7-dihydroxy-4'-methoxyisoflavanone

Default Structure
ChEBI IDCHEBI:62734
ChEBI Name2,7-dihydroxy-4'-methoxyisoflavanone
Stars
DefinitionA hydroxyisoflavanone that is isoflavanone bearing hydroxy groups at the 2 and 7 positions, and a methoxy group at the 4' position.
Last Modified17 February 2017
SubmitterGareth Owen
DownloadsMolfile
FormulaC16H14O5
Net Charge0
Average Mass286.283
Monoisotopic Mass286.08412
SMILESCOc1ccc(C2C(=O)c3ccc(O)cc3OC2O)cc1
InChIInChI=1S/C16H14O5/c1-20-11-5-2-9(3-6-11)14-15(18)12-7-4-10(17)8-13(12)21-16(14)19/h2-8,14,16-17,19H,1H3
InChIKeyPKQQPELXMZRYJY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2,7-dihydroxy-4'-methoxyisoflavanone (CHEBI:62734) is a hydroxyisoflavanone (CHEBI:72739)
2,7-dihydroxy-4'-methoxyisoflavanone (CHEBI:62734) is a lactol (CHEBI:38131)
2,7-dihydroxy-4'-methoxyisoflavanone (CHEBI:62734) is a methoxyisoflavanone (CHEBI:72740)
Incoming Relation(s)
(2R,3S)-2,7-dihydroxy-4'-methoxyisoflavanone (CHEBI:85906) is a 2,7-dihydroxy-4'-methoxyisoflavanone (CHEBI:62734)
IUPAC Name 
2,7-dihydroxy-3-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one
UniProt Name  Source
2,7-dihydroxy-4'-methoxyisoflavanoneUniProt
Manual XrefsDatabases
C16190KEGG COMPOUND
CPD-3502MetaCyc