CHEBI:48709 - 8-hydroxy-3,4,5-trimethyl-6-oxo-4,6-dihydro-3H-isochromene-7-carboxylic acid

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 8-hydroxy-3,4,5-trimethyl-6-oxo-4,6-dihydro-3H-isochromene-7-carboxylic acid ChEBI ID CHEBI:48709 ChEBI ASCII Name 8-hydroxy-3,4,5-trimethyl-6-oxo-4,6-dihydro-3H-isochromene-7-carboxylic acid 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 C13H14O5 Net Charge 0 Average Mass 250.24726 Monoisotopic Mass 250.08412 InChI InChI=1S/C13H14O5/c1-5-7(3)18-4-8-9(5)6(2)11(14)10(12(8)15)13(16)17/h4-5,7,15H,1-3H3,(H,16,17) InChIKey CQIUKKVOEOPUDV-UHFFFAOYSA-N SMILES CC1OC=C2C(O)=C(C(O)=O)C(=O)C(C)=C2C1C ChEBI Ontology Outgoing 8-hydroxy-3,4,5-trimethyl-6-oxo-4,6-dihydro-3H-isochromene-7-carboxylic acid (CHEBI:48709) is a isochromenes (CHEBI:38761) Incoming citrinin (CHEBI:48708) is a 8-hydroxy-3,4,5-trimethyl-6-oxo-4,6-dihydro-3H-isochromene-7-carboxylic acid (CHEBI:48709) IUPAC Name 8-hydroxy-3,4,5-trimethyl-6-oxo-4,6-dihydro-3H-isochromene-7-carboxylic acid Registry Number Type Source 240384 Beilstein Registry Number Beilstein Last Modified 02 December 2009