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CHEBI:51666 - 7-methoxycoumarin-4-acetic acid

ChEBI IDCHEBI:51666
ChEBI Name7-methoxycoumarin-4-acetic acid
Stars
Secondary ChEBI IDCHEBI:110724
Last Modified15 November 2010
SubmitterInma Spiteri
DownloadsMolfile
FormulaC12H10O5
Net Charge0
Average Mass234.207
Monoisotopic Mass234.05282
SMILESCOc1ccc2c(CC(=O)O)cc(=O)oc2c1
InChIInChI=1S/C12H10O5/c1-16-8-2-3-9-7(4-11(13)14)5-12(15)17-10(9)6-8/h2-3,5-6H,4H2,1H3,(H,13,14)
InChIKeyZEKAXIFHLIITGV-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
7-methoxycoumarin-4-acetic acid (CHEBI:51666) has functional parent coumarin (CHEBI:28794)
7-methoxycoumarin-4-acetic acid (CHEBI:51666) has role fluorochrome (CHEBI:51217)
7-methoxycoumarin-4-acetic acid (CHEBI:51666) is a monocarboxylic acid (CHEBI:25384)
IUPAC Name 
(7-methoxy-2-oxo-2H-chromen-4-yl)acetic acid
Synonym  Source
7-Methoxy-2-oxo-2H-1-benzopyran-4-acetic acidChEBI
Registry NumbersSources
Beilstein:221128Beilstein