CHEBI:91120 - 4-methylumbelliferyl butyate

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ChEBI Name 4-methylumbelliferyl butyate
ChEBI ID CHEBI:91120
Definition A member of the class of coumarins that is 4-methylumbelliferone in which the hydroxyl hydrogen is replaced by a butyryl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C14H14O4
Net Charge 0
Average Mass 246.259
Monoisotopic Mass 246.089
InChI InChI=1S/C14H14O4/c1-3-4-13(15)17-10-5-6-11-9(2)7-14(16)18-12(11)8-10/h5-8H,3-4H2,1-2H3
InChIKey WKPUJZVCZXWKCK-UHFFFAOYSA-N
SMILES C1=2OC(=O)C=C(C1=CC=C(C2)OC(=O)CCC)C
Roles Classification
Application(s): chromogenic compound
Colourless, endogenous or exogenous pigment precursors that may be transformed by biological mechanisms into coloured compounds. They are used in biochemical assays and in diagnosis as indicators, particularly in the form of enzyme substrates.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 4-methylumbelliferyl butyate (CHEBI:91120) has functional parent 4-methylumbelliferone (CHEBI:17224)
4-methylumbelliferyl butyate (CHEBI:91120) has role chromogenic compound (CHEBI:75050)
4-methylumbelliferyl butyate (CHEBI:91120) is a butyrate ester (CHEBI:50477)
4-methylumbelliferyl butyate (CHEBI:91120) is a coumarins (CHEBI:23403)
IUPAC Name
4-methyl-2-oxo-2H-1-benzopyran-7-yl butanoate
Synonyms Sources
4-Methyl-2-oxo-2H-1-benzopyran-7-yl butyrate ChemIDplus
4-Methylcoumarin-7-yl butyrate ChemIDplus
4-Methylumbelliferone butyrate ChemIDplus
4-methylumbelliferyl butanoate ChEBI
7-(propylcarbonyl)oxy-4-methyl-2H-1-benzopyran-2-one ChEBI
Butanoic acid, 4-methyl-2-oxo-2H-1-benzopyran-7-yl ester ChemIDplus
Butyryl 4-methylumbelliferone ChemIDplus
Registry Numbers Types Sources
17695-46-4 CAS Registry Number ChemIDplus
227973 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
7430693 PubMed citation Europe PMC
Last Modified
05 February 2016