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287100-84-9

287100-84-9 Structure

287100-84-9 Structure
IdentificationBack Directory
[Name]

GLYCERYL TRI(OCTADECANOATE-1-13C)
[CAS]

287100-84-9
[Synonyms]

TRISTEARIN-1,1,1-13C3
TRISTEARIN-CARBOXYL-13C3
GLYCERYL TRI(STEARATE-1-13C)
GLYCERYL TRI(OCTADECANOATE-1-13C)
TRISTEARIN-CARBOXYL-13C3, 99 ATOM % 13C
Glyceryl tri(octadecanoate-1-13C), Tristearin-carboxyls-13C3
[Molecular Formula]

C57H110O6
[MDL Number]

MFCD00083977
[MOL File]

287100-84-9.mol
[Molecular Weight]

894.51
Chemical PropertiesBack Directory
[Melting point ]

72-75 °C(lit.)
[form ]

solid
[InChIKey]

DCXXMTOCNZCJGO-FIXLHGMNSA-N
[SMILES]

CCCCCCCCCCCCCCCCC[13C](=O)OCC(CO[13C](=O)CCCCCCCCCCCCCCCCC)O[13C](=O)CCCCCCCCCCCCCCCCC
Safety DataBack Directory
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

Tristearin-13C3 (Glycerol tristearate-13C3) is 13C labeled Tristearin. Tristearin is a triglyceride derived from three units of stearic acid[1][1][2].
[References]

[1] Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216. DOI:10.1177/1060028018797110
[2] Pizzirusso A, et al. Molecular Insights into the Eutectic Tripalmitin/Tristearin Binary System. J Am Chem Soc. 2018 Oct 3;140(39):12405-12414. DOI:10.1021/jacs.8b04729
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