Products 1298086-18-6

CAS 1298086-18-6 appears in our catalog under these names: Ertugliflozin Impurity 4, Ertugliflozin Impurity 5, Ertugliflozin Tetraacetate, (1R,2S,3S,4R,5S)-1-(Acetoxymethyl)-5-(4-chloro-3-(4-ethoxybenzyl)phenyl)-6,8-dioxabicyclo[3.2.1]octane-2,3,4-triyl triacetate 95%. Offered by: Chemat Brand, Hubei YoungXin, TRC, Ambeed. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg, 250mg, 1g.

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

[(1R,2S,3S,4R,5S)-2,3,4-triacetyloxy-5-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-6,8-dioxabicyclo[3.2.1]octan-1-yl]methyl acetate (CAS 1298086-18-6) is a chemical compound with the molecular formula C30H33ClO11 and a molecular weight of 605.0 g/mol. IUPAC name: [(1R,2S,3S,4R,5S)-2,3,4-triacetyloxy-5-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-6,8-dioxabicyclo[3.2.1]octan-1-yl]methyl acetate. InChIKey: LFZVLROKLDGLRV-KTBGKDHWSA-N.

Identity
Molecular formulaC30H33ClO11
Molecular weight605.0 g/mol
IUPAC name[(1R,2S,3S,4R,5S)-2,3,4-triacetyloxy-5-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-6,8-dioxabicyclo[3.2.1]octan-1-yl]methyl acetate
InChIKeyLFZVLROKLDGLRV-KTBGKDHWSA-N
SMILESCCOC1=CC=C(C=C1)CC2=C(C=CC(=C2)[C@@]34[C@@H]([C@H]([C@@H]([C@@](O3)(CO4)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)Cl

Computed by PubChem (NCBI)