7-Hydroxy-3-(hydroxymethyl)-5-methylisochromen-1-one (CHEBI:181505)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	7-Hydroxy-3-(hydroxymethyl)-5-methylisochromen-1-one

ChEBI ID	CHEBI:181505

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

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Formula

C11H10O4

Net Charge

Average Mass

206.197

Monoisotopic Mass

206.05791

InChI

InChI=1S/C11H10O4/c1-6-2-7(13)3-10-9(6)4-8(5-12)15-11(10)14/h2-4,12-13H,5H2,1H3

InChIKey

LTGJEIZAUFPWTC-UHFFFAOYSA-N

SMILES

O1C(=CC2=C(C=C(O)C=C2C)C1=O)CO

ChEBI Ontology
Outgoing	7-Hydroxy-3-(hydroxymethyl)-5-methylisochromen-1-one (CHEBI:181505) is a isocoumarins (CHEBI:38758)

IUPAC Name

7-hydroxy-3-(hydroxymethyl)-5-methylisochromen-1-one