CHEBI:137402 - 6-chloro-4-hydroxycoumarin

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ChEBI Name 6-chloro-4-hydroxycoumarin ChEBI ID CHEBI:137402 Definition A hydroxycoumarin that is coumarin in which a hydroxy group replaces the hydrogen at position 4 and a chloro substituent replaces the hydrogen at position 6. 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 C9H5ClO3 Net Charge 0 Average Mass 196.587 Monoisotopic Mass 195.99272 InChI InChI=1S/C9H5ClO3/c10-5-1-2-8-6(3-5)7(11)4-9(12)13-8/h1-4,11H InChIKey HUMZENGQNOATEQ-UHFFFAOYSA-N SMILES C=12C=CC(=CC1C(=CC(O2)=O)O)Cl ChEBI Ontology Outgoing 6-chloro-4-hydroxycoumarin (CHEBI:137402) is a hydroxycoumarin (CHEBI:37912) 6-chloro-4-hydroxycoumarin (CHEBI:137402) is a organochlorine compound (CHEBI:36683) IUPAC Name 6-chloro-4-hydroxy-2H-chromen-2-one Synonyms Sources 4-hydroxy-6-chloro-2H-chromen-2-one ChEBI 4-hydroxy-6-chlorocoumarin ChEBI 6-chloro-4-hydroxy-2H-1-benzopyran-2-one IUPAC 6-chloro-4-hydroxycoumarin ChEBI Registry Number Type Source 1243180 Reaxys Registry Number Reaxys Citation Type Source 28166217 PubMed citation Europe PMC Last Modified 13 June 2017