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Fingolimod-[d4]

General Information
Catalog: BLP-011581
CAS: 1346747-38-3
Molecular Formula: C19H29D4NO2
Molecular Weight: 311.50
Chemical Structure
Fingolimod-[d4]
Description Fingolimod-[d4] is the labelled analogue of Fingolimod. Fingolimod is an antagonist of S1P which is an extracellular lipid mediator. Fingolimod has been used as an immunomodulating drug to treat multiple sclerosis (MS).
Synonyms Fingolimod-d4; 2-Amino-2-(2-(4-octylphenyl)ethyl)propane-1,3-diol-d4; 2-amino-2-(4-octylphenethyl)propane-1,1,3,3-d4-1,3-diol; FTY720-d4
IUPAC Name 2-amino-1,1,3,3-tetradeuterio-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol
Related CAS 162359-55-9 (unlabelled) 162359-56-0 (unlabelled hydrochloride)
Canonical SMILES CCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)N
InChI InChI=1S/C19H33NO2/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)13-14-19(20,15-21)16-22/h9-12,21-22H,2-8,13-16,20H2,1H3/i15D2,16D2
InChI Key KKGQTZUTZRNORY-ONNKGWAKSA-N
Purity ≥98% by HPLC; 98% atom D
Solubility Soluble in Chloroform (Very Slightly, Heated), DMSO (Slightly, Heated), Methanol (Slightly, Heated)
Appearance White Solid
Storage Store at 2-8°C

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