Products 99043-04-6

CAS 99043-04-6 appears in our catalog under these names: Mycophenolic Acid Acyl-Beta-D-glucuronide, >95% (HPLC), Mycophenolic Acid Acyl–β–D–glucuronide, Mycophenolic acid acyl-b-D-glucuronide, Mycophenolic acid acyl-β-D-glucuronide. Offered by: TRC, GLPBio, Chemat, MedChemExpress. Available pack sizes: 10mg, 1mg, 5mg, 2mg, 1 mg.

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

Mycophenolic acid O-acyl-glucuronide is a carboxylic ester resulting from the formal condensation of the carboxylic acid group of mycophenolic acid with the anomeric hydroxy group of beta-D-glucuronic acid. It is a beta-D-glucosiduronic acid, a carboxylic ester, a member of phenols and a gamma-lactone. It is functionally related to a mycophenolic acid and a beta-D-glucuronic acid. It is a conjugate acid of a mycophenolic acid O-acyl-glucuronide(1-).

Source: ChEBI

Identity
Molecular formulaC23H28O12
Molecular weight496.5 g/mol
IUPAC name(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoyl]oxyoxane-2-carboxylic acid
InChIKeyQBMSTEZXAMABFF-UEARNRKISA-N
SMILESCC1=C2COC(=O)C2=C(C(=C1OC)C/C=C(\C)/CCC(=O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)O

Computed by PubChem (NCBI)