Product Code

TRC-F342057

Product Format

Neat

Molecular Formula

C37H63D4NO3

Molecular Weight

577.96

Product Categories

TRC, Stable isotopes

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

1242271-27-7

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Fingolimod Stearoate Amide-d4

Molecular Formula

C37H63D4NO3

Molecular Weight

577.96

Accurate Mass

577.54

SMILES

O=C(CCCCCCCCCCCCCCCCC)NC(C([2H])([2H])O)(CCC1=CC=C(CCCCCCCC)C=C1)C([2H])([2H])O

InChI

InChI=1S/C37H67NO3/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-21-23-25-36(41)38-37(32-39,33-40)31-30-35-28-26-34(27-29-35)24-22-20-10-8-6-4-2/h26-29,39-40H,3-25,30-33H2,1-2H3,(H,38,41)/i32D2,33D2

IUPAC

N-(1-hydroxy-2-(hydroxymethyl-d2)-4-(4-octylphenyl)butan-2-yl-1,1-d2)stearamide

Unlabelled CAS Number

1242271-27-7

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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