EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:58813 - leachianone G(1−)

ChEBI IDCHEBI:58813
ChEBI Nameleachianone G(1−)
Stars
ASCII Nameleachianone G(1-)
DefinitionConjugate base of leachianone G arising from deprotonation of the 7-hydroxy group.
Last Modified22 March 2014
DownloadsMolfile
FormulaC20H19O6
Net Charge-1
Average Mass355.366
Monoisotopic Mass355.11871
SMILESCC(C)=CCc1c([O-])cc(O)c2c1O[C@H](c1ccc(O)cc1O)CC2=O
InChIInChI=1S/C20H20O6/c1-10(2)3-5-13-15(23)8-16(24)19-17(25)9-18(26-20(13)19)12-6-4-11(21)7-14(12)22/h3-4,6-8,18,21-24H,5,9H2,1-2H3/p-1/t18-/m0/s1
InChIKeyVBOYLFNGTSLAAZ-SFHVURJKSA-M
ChEBI Ontology
Outgoing Relation(s)
leachianone G(1−) (CHEBI:58813) is a flavonoid oxoanion (CHEBI:60038)
leachianone G(1−) (CHEBI:58813) is conjugate base of leachianone G (CHEBI:50208)
Incoming Relation(s)
leachianone G (CHEBI:50208) is conjugate acid of leachianone G(1−) (CHEBI:58813)
IUPAC Name 
(2S)-2-(2,4-dihydroxyphenyl)-5-hydroxy-8-(3-methylbut-2-en-1-yl)-4-oxochroman-7-olate
Synonyms  Source
leachianone G anionChEBI
(2S)-2-(2,4-dihydroxyphenyl)-5-hydroxy-8-(3-methylbut-2-en-1-yl)-4-oxo-3,4-dihydro-2H-1-benzopyran-7-olateChEBI
Manual XrefsDatabases
CPD-9442MetaCyc