Products 40336-80-9

CAS 40336-80-9 appears in our catalog under these names: Mycophenolic Acid Impurity 5, Isopropyl Mycophenolate. Offered by: Chemat Brand, Mikromol. Available pack sizes: on request, 25mg.

Mycophenolic Acid Impurity 5
Chemat Brand
  • size: on request
  • Variants: 1
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Isopropyl Mycophenolate
Mikromol
  • size: 25mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

Propan-2-yl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate (CAS 40336-80-9) is a chemical compound with the molecular formula C20H26O6 and a molecular weight of 362.4 g/mol. IUPAC name: propan-2-yl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate. InChIKey: NLMMDPJTMSIANX-WUXMJOGZSA-N.

Identity
Molecular formulaC20H26O6
Molecular weight362.4 g/mol
IUPAC namepropan-2-yl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
InChIKeyNLMMDPJTMSIANX-WUXMJOGZSA-N
SMILESCC1=C2COC(=O)C2=C(C(=C1OC)C/C=C(\C)/CCC(=O)OC(C)C)O

Computed by PubChem (NCBI)

Synonyms: Isopropyl Mycophenolate, Mycophenolic Acid Impurity N3, Mycophenolic Acid Impurity 44
Isomers (same molecular formula)
methyl (1R,2R,5S,8S,9S,10R,11S,12S)-5,12-dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylate C20H26O6
(4aR,6S,7S,8S,8aR)-6-methoxy-2-phenyl-7,8-bis(prop-2-enoxy)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine C20H26O6
(1S,2S,3S,4R,8R,9R,12S)-8-formyl-12-hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid C20H26O6
(2S,3S)-2,3-bis[(4-hydroxy-3-methoxyphenyl)methyl]butane-1,4-diol C20H26O6
(E)-8-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-2,6-dimethyloct-6-enoic acid C20H26O6