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CHEBI:77711 - licodione(1−)

ChEBI IDCHEBI:77711
ChEBI Namelicodione(1−)
Stars
ASCII Namelicodione(1-)
DefinitionA phenolate anion obtained by deprotonation of the 4'-hydroxy group of licodione. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Last Modified19 June 2014
SubmitterAnne Morgat
DownloadsMolfile
FormulaC15H11O5
Net Charge-1
Average Mass271.248
Monoisotopic Mass271.06120
SMILESO=C(CC(=O)c1ccc(O)cc1O)c1ccc([O-])cc1
InChIInChI=1S/C15H12O5/c16-10-3-1-9(2-4-10)13(18)8-15(20)12-6-5-11(17)7-14(12)19/h1-7,16-17,19H,8H2/p-1
InChIKeyQIEKMEBGIJSGGB-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
licodione(1−) (CHEBI:77711) is a phenolate anion (CHEBI:50525)
licodione(1−) (CHEBI:77711) is conjugate base of licodione (CHEBI:18131)
Incoming Relation(s)
licodione (CHEBI:18131) is conjugate acid of licodione(1−) (CHEBI:77711)
IUPAC Name 
4-[3-(2,4-dihydroxyphenyl)-3-oxopropanoyl]phenolate
UniProt Name  Source
licodioneUniProt