Product Code

TRC-F342052

Product Format

Neat

Molecular Formula

C35H59D4NO3

Molecular Weight

549.92

Product Categories

TRC, Stable isotopes

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

1242271-26-6

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Fingolimod Palmitate Amide-d4

Molecular Formula

C35H59D4NO3

Molecular Weight

549.92

Accurate Mass

549.51

SMILES

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

InChI

InChI=1S/C35H63NO3/c1-3-5-7-9-11-12-13-14-15-16-17-19-21-23-34(39)36-35(30-37,31-38)29-28-33-26-24-32(25-27-33)22-20-18-10-8-6-4-2/h24-27,37-38H,3-23,28-31H2,1-2H3,(H,36,39)/i30D2,31D2

IUPAC

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

Unlabelled CAS Number

1242271-26-6

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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