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CHEBI:57480 - 2,3-dihydrobiochanin A(1−)

ChEBI IDCHEBI:57480
ChEBI Name2,3-dihydrobiochanin A(1−)
Stars
ASCII Name2,3-dihydrobiochanin A(1-)
DefinitionConjugate base of 2,3-dihydrobiochanin A arising from selective deprotonation of the 7-hydroxy group.
Last Modified10 March 2014
DownloadsMolfile
FormulaC16H13O5
Net Charge-1
Average Mass285.275
Monoisotopic Mass285.07685
SMILESCOc1ccc(C2COc3cc([O-])cc(O)c3C2=O)cc1
InChIInChI=1S/C16H14O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-7,12,17-18H,8H2,1H3/p-1
InChIKeyXPZQBSCTDLGDBP-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
2,3-dihydrobiochanin A(1−) (CHEBI:57480) is a organic anion (CHEBI:25696)
2,3-dihydrobiochanin A(1−) (CHEBI:57480) is conjugate base of 2,3-dihydrobiochanin A (CHEBI:15712)
Incoming Relation(s)
2,3-dihydrobiochanin A (CHEBI:15712) is conjugate acid of 2,3-dihydrobiochanin A(1−) (CHEBI:57480)
IUPAC Name 
5-hydroxy-3-(4-methoxyphenyl)-4-oxochroman-7-olate
Synonyms  Source
2,3-dihydrobiochanin A anionChEBI
5-hydroxy-3-(4-methoxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-7-olateChEBI