EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:78328 - scutellarein(1−)

ChEBI IDCHEBI:78328
ChEBI Namescutellarein(1−)
Stars
ASCII Namescutellarein(1-)
DefinitionA flavonoid oxoanion that is the conjugate base of scutellarein, obtained by selective deprotonation of the 7-hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Last Modified22 October 2014
SubmitterAnne Morgat
DownloadsMolfile
FormulaC15H9O6
Net Charge-1
Average Mass285.231
Monoisotopic Mass285.04046
SMILESO=c1cc(-c2ccc(O)cc2)oc2cc([O-])c(O)c(O)c12
InChIInChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)11-5-9(17)13-12(21-11)6-10(18)14(19)15(13)20/h1-6,16,18-20H/p-1
InChIKeyJVXZRQGOGOXCEC-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
scutellarein(1−) (CHEBI:78328) is a flavonoid oxoanion (CHEBI:60038)
scutellarein(1−) (CHEBI:78328) is conjugate base of scutellarein (CHEBI:9062)
Incoming Relation(s)
scutellarein (CHEBI:9062) is conjugate acid of scutellarein(1−) (CHEBI:78328)
IUPAC Name 
5,6-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-olate
UniProt Name  Source
scutellareinUniProt