N-Acetyl-S-(3,4-dihydroxybutyl)-L-cysteine-d7 (Mixture of Diastereomers)

Analyte Name

N-Acetyl-S-(3,4-dihydroxybutyl)-L-cysteine-d7 (mixture of diastereomers)

CAS Number

1240398-27-9

Molecular Formula

C9 2H7 H10 N O5 S

Molecular Weight

258.34

Accurate Mass

258.1267

SMILES

[2H]C([2H])(O)C([2H])(O)C([2H])([2H])C([2H])([2H])SC[C@H](NC(=O)C)C(=O)O

InChI

InChI=1S/C9H17NO5S/c1-6(12)10-8(9(14)15)5-16-3-2-7(13)4-11/h7-8,11,13H,2-5H2,1H3,(H,10,12)(H,14,15)/t7?,8-/m0/s1/i2D2,3D2,4D2,7D

IUPAC

(2R)-2-acetamido-3-(1,1,2,2,3,4,4-heptadeuterio-3,4-dihydroxybutyl)sulfanylpropanoic acid

Unlabelled CAS Number

144889-50-9

SIL Type

Deuterium

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite; Stable Isotope Labelled

Product Format

Neat

Purity

>95% (HPLC)