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CHEBI:51773 - coumarin 153

Default Structure
ChEBI IDCHEBI:51773
ChEBI Namecoumarin 153
Stars
Last Modified4 February 2009
SubmitterInma Spiteri
DownloadsMolfile
FormulaC16H14F3NO2
Net Charge0
Average Mass309.287
Monoisotopic Mass309.09766
SMILESO=c1cc(C(F)(F)F)c2cc3c4c(c2o1)CCCN4CCC3
InChIInChI=1S/C16H14F3NO2/c17-16(18,19)12-8-13(21)22-15-10-4-2-6-20-5-1-3-9(14(10)20)7-11(12)15/h7-8H,1-6H2
InChIKeyVSSSHNJONFTXHS-UHFFFAOYSA-N
Roles Classification
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
coumarin 153 (CHEBI:51773) has role fluorochrome (CHEBI:51217)
coumarin 153 (CHEBI:51773) is a 7-aminocoumarins (CHEBI:51769)
IUPAC Name 
9-(trifluoromethyl)-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11-one
Synonyms  Source
1H,5H,11H-(1)Benzopyrano(6,7,8-ij)quinolizin-11-one,2,3,6,7-tetrahydro-9-(trifluoromethyl)-ChemIDplus
2,3,6,7-Tetrahydro-9-(trifluoromethyl)-1H,5H,11H-(1)benzopyrano(6,7,8-ij)quinolizin-11-oneChemIDplus
Registry NumbersSources
Beilstein:3624201Beilstein
CAS:53518-18-6ChemIDplus