Products 39938-00-6

CAS 39938-00-6 is the registry number for Methyl 6-(methyl-2,3,4-tri-O-acetyl-b-D-glucuronato)mycophenolate. Offered by: Biosynth. Available pack sizes: 25mg, 10mg, 50mg.

Methyl 6-(methyl-2,3,4-tri-O-acetyl-b-D-glucuronato)mycophenolate
Biosynth
  • size: 25mg, 10mg, 50mg
  • Variants: 3
View product
Structural formula: {0} (CAS {1})

Methyl (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[[6-methoxy-5-[(E)-6-methoxy-3-methyl-6-oxohex-2-enyl]-7-methyl-3-oxo-1H-2-benzofuran-4-yl]oxy]oxane-2-carboxylate (CAS 39938-00-6) is a chemical compound with the molecular formula C31H38O15 and a molecular weight of 650.6 g/mol. IUPAC name: methyl (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[[6-methoxy-5-[(E)-6-methoxy-3-methyl-6-oxohex-2-enyl]-7-methyl-3-oxo-1H-2-benzofuran-4-yl]oxy]oxane-2-carboxylate. InChIKey: CASHVQZBXMURJN-VUCNFRLOSA-N.

Identity
Molecular formulaC31H38O15
Molecular weight650.6 g/mol
IUPAC namemethyl (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[[6-methoxy-5-[(E)-6-methoxy-3-methyl-6-oxohex-2-enyl]-7-methyl-3-oxo-1H-2-benzofuran-4-yl]oxy]oxane-2-carboxylate
InChIKeyCASHVQZBXMURJN-VUCNFRLOSA-N
SMILESCC1=C2COC(=O)C2=C(C(=C1OC)C/C=C(\C)/CCC(=O)OC)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C

Computed by PubChem (NCBI)

Synonyms: Methyl 6-[Methyl-2,3,4-tri-O-acetyl--D-glucuronato]mycophenolate, Mycophenolic Acid Methyl Ester 6-(Tri-O-acetyl-b-D-glucuronic Acid Methyl Ester), Methyl 6-[Methyl-2,3,4-tri-O-acetyl-?-D-glucuronato]mycophenolate
Isomers (same molecular formula)
[(2R,3R,4S,5R,6R)-5-acetyloxy-6-[2-(3,4-dihydroxyphenyl)ethoxy]-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate C31H38O15