1-oxo-1H-isochromene-3-carboxylic acid (CHEBI:192116)

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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	1-oxo-1H-isochromene-3-carboxylic acid

ChEBI ID	CHEBI:192116

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

Submitter	MetaboLights

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Download	Molfile XML SDF

Formula

C10H6O4

Net Charge

Average Mass

190.154

Monoisotopic Mass

190.02661

InChI

InChI=1S/C10H6O4/c11-9(12)8-5-6-3-1-2-4-7(6)10(13)14-8/h1-5H,(H,11,12)

InChIKey

CRPAMTZHVXHTKH-UHFFFAOYSA-N

SMILES

O1C(=CC=2C(=CC=CC2)C1=O)C(O)=O

Metabolite of Species	Details
Marine plankton environmental sample (NCBI:txid632957)	Found in endometabolome (MTBLS:000125). See: MetaboLights Study

ChEBI Ontology
Outgoing	1-oxo-1H-isochromene-3-carboxylic acid (CHEBI:192116) is a isocoumarins (CHEBI:38758)

IUPAC Name

1-oxoisochromene-3-carboxylic acid