Analyte Name

rac-1,2-Distearoyl-3-chloropropanediol-13C3

CAS Number

2740880-40-2

Molecular Formula

13C3 C36 H75 Cl O4

Molecular Weight

646.441

Accurate Mass

645.545

SMILES

CCCCCCCCCCCCCCCCCC(=O)O[13CH2][13CH]([13CH2]Cl)OC(=O)CCCCCCCCCCCCCCCCC

InChI

InChI=1S/C39H75ClO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37H,3-36H2,1-2H3/i35+1,36+1,37+1

IUPAC

(3-chloro-2-octadecanoyloxy(1,2,3-13C3)propyl) octadecanoate

Unlabelled CAS Number

72468-92-9

SIL Type

Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled; Bioactive Small Molecule

Product Format

Neat