Products 19165-63-0

CAS 19165-63-0 appears in our catalog under these names: Ochratoxin Alpha, alpha-Ochratoxin 10 μg/mL in Acetonitrile, Ochratoxin α, Ochratoxin α. Offered by: Chemat Brand, Dr. Ehrenstorfer, TargetMol, GLPBio, Biosynth. Available pack sizes: on request, 1ml, 2mg, 5mg, 1mg, 10mg, 25mg, 0,5mg.

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

Ochratoxin alpha is a member of the class of isocoumarins that is 1-oxo-3,4-dihydro-2-benzopyran-7-carboxylic acid carrying additional methyl, chloro and hydroxy substituents at positions 3, 5 and 8 respectively. A non-toxic metabolite of the mycotoxin ochratoxin A. It has a role as a human xenobiotic metabolite, a bacterial xenobiotic metabolite, a marine xenobiotic metabolite and a human urinary metabolite. It is a member of benzoic acids, a member of phenols, an organochlorine compound, a member of isocoumarins and a member of isochromanes. It is a conjugate acid of an ochratoxin alpha(1-).

Source: ChEBI

Identity
Molecular formulaC11H9ClO5
Molecular weight256.64 g/mol
IUPAC name(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carboxylic acid
InChIKeyOSFWJKYWJMZKSM-SCSAIBSYSA-N
SMILESC[C@@H]1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)O)Cl

Computed by PubChem (NCBI)