Products 2193052-06-9

CAS 2193052-06-9 is the registry number for (1R,2R)-1-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-octanamido-3-(pyrrolidin-1-yl)propyl octanoate. Offered by: Biosynth. Available pack sizes: 2mg, 1mg, 5mg, 10mg.

(1R,2R)-1-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-octanamido-3-(pyrrolidin-1-yl)propyl octanoate
Biosynth
  • size: 2mg, 1mg, 5mg, 10mg
  • Variants: 4
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Structural formula: {0} (CAS {1})

[(1R,2R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(octanoylamino)-3-pyrrolidin-1-ylpropyl] octanoate (CAS 2193052-06-9) is a chemical compound with the molecular formula C31H50N2O5 and a molecular weight of 530.7 g/mol. IUPAC name: [(1R,2R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(octanoylamino)-3-pyrrolidin-1-ylpropyl] octanoate. InChIKey: WMQLMDJNHZLPPC-MXBOTTGLSA-N.

Identity
Molecular formulaC31H50N2O5
Molecular weight530.7 g/mol
IUPAC name[(1R,2R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(octanoylamino)-3-pyrrolidin-1-ylpropyl] octanoate
InChIKeyWMQLMDJNHZLPPC-MXBOTTGLSA-N
SMILESCCCCCCCC(=O)N[C@H](CN1CCCC1)[C@@H](C2=CC3=C(C=C2)OCCO3)OC(=O)CCCCCCC

Computed by PubChem (NCBI)

Synonyms: Eliglustat O-octonyl dimer, Eliglustat Impurity 2
Isomers (same molecular formula)
[(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-acetyloxy-10,13-dimethyl-2-morpholin-4-yl-16-pyrrolidin-1-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate C31H50N2O5