Products 522-53-2

CAS 522-53-2 appears in our catalog under these names: Lobaric acid, Lobaric Acid, Lobaric acid(aS), Lobaric acid, 95.2%. Offered by: TargetMol, GLPBio, Biosynth, MedChemExpress. Available pack sizes: 500ug, 2500ug, 500μg, 2,5mg, 0,5mg, 0,25mg, 1mg, 2mg.

Structural formula: {0} (CAS {1})

3-hydroxy-9-methoxy-6-oxo-7-pentanoyl-1-pentylbenzo[b][1,4]benzodioxepine-2-carboxylic acid (CAS 522-53-2) is a chemical compound with the molecular formula C25H28O8 and a molecular weight of 456.5 g/mol. IUPAC name: 3-hydroxy-9-methoxy-6-oxo-7-pentanoyl-1-pentylbenzo[b][1,4]benzodioxepine-2-carboxylic acid. InChIKey: JHEWMLHQNRHTQX-UHFFFAOYSA-N.

Identity
Molecular formulaC25H28O8
Molecular weight456.5 g/mol
IUPAC name3-hydroxy-9-methoxy-6-oxo-7-pentanoyl-1-pentylbenzo[b][1,4]benzodioxepine-2-carboxylic acid
InChIKeyJHEWMLHQNRHTQX-UHFFFAOYSA-N
SMILESCCCCCC1=C(C(=CC2=C1OC3=CC(=CC(=C3C(=O)O2)C(=O)CCCC)OC)O)C(=O)O

Computed by PubChem (NCBI)