CHEBI:51940 - coumarin 504

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ChEBI Name coumarin 504
ChEBI ID CHEBI:51940
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C18H19NO4
Net Charge 0
Average Mass 313.34780
Monoisotopic Mass 313.13141
InChI InChI=1S/C18H19NO4/c1-2-22-17(20)14-10-12-9-11-5-3-7-19-8-4-6-13(15(11)19)16(12)23-18(14)21/h9-10H,2-8H2,1H3
InChIKey VMJKUPWQKZFFCX-UHFFFAOYSA-N
SMILES CCOC(=O)c1cc2cc3CCCN4CCCc(c34)c2oc1=O
Roles Classification
Application(s): fluorochrome
A fluorescent dye used to stain biological specimens.
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ChEBI Ontology
Outgoing coumarin 504 (CHEBI:51940) has role fluorochrome (CHEBI:51217)
coumarin 504 (CHEBI:51940) is a 7-aminocoumarins (CHEBI:51769)
coumarin 504 (CHEBI:51940) is a ethyl ester (CHEBI:23990)
IUPAC Name
ethyl 11-oxo-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinoline-10-carboxylate
Synonym Source
Coumarin 314 ChEBI
Registry Numbers Types Sources
5123844 Beilstein Registry Number Beilstein
55804-66-5 CAS Registry Number ChemIDplus
Last Modified
02 March 2015