CHEBI:63236 - pacific blue

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ChEBI Name pacific blue ChEBI ID CHEBI:63236 Definition A hydroxycoumarin having the hydroxy group located at position 7 and bearing two fluoro substituents at positions 6 and 8 as well as a carboxy group at position 3. A fluorescent dye of excitation wavelength 403 nm and emission wavelength 455 nm. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C10H4F2O5 Net Charge 0 Average Mass 242.13260 Monoisotopic Mass 242.00268 InChI InChI=1S/C10H4F2O5/c11-5-2-3-1-4(9(14)15)10(16)17-8(3)6(12)7(5)13/h1-2,13H,(H,14,15) InChIKey VYNDHICBIRRPFP-UHFFFAOYSA-N SMILES OC(=O)c1cc2cc(F)c(O)c(F)c2oc1=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Application(s): fluorochrome A fluorescent dye used to stain biological specimens. View more via ChEBI Ontology ChEBI Ontology Outgoing pacific blue (CHEBI:63236) has role fluorochrome (CHEBI:51217) pacific blue (CHEBI:63236) is a hydroxycoumarin (CHEBI:37912) pacific blue (CHEBI:63236) is a monocarboxylic acid (CHEBI:25384) pacific blue (CHEBI:63236) is a organofluorine compound (CHEBI:37143) Incoming pacific blue succinimidyl ester (CHEBI:63240) has functional parent pacific blue (CHEBI:63236) IUPAC Name 6,8-difluoro-7-hydroxy-2-oxo-2H-chromene-3-carboxylic acid Synonym Source 6,8-difluoro-7-hydroxy-3-carboxycoumarin ChEBI Registry Number Type Source 8067623 Reaxys Registry Number Reaxys Citations Types Sources 19245228 PubMed citation Europe PMC 20000340 PubMed citation Europe PMC 20824632 PubMed citation Europe PMC Last Modified 23 November 2011