Clindamycin-13C,D3

Analyte Name

Clindamycin-13C,D3

CAS Number

2140264-63-5

Molecular Formula

13C C17 D3 H30 Cl N2 O5 S

Molecular Weight

428.99

Accurate Mass

428.2021

SMILES

[2H][13C]([2H])([2H])N1C[C@H](CCC)C[C@H]1C(=O)N[C@H]([C@H](C)Cl)[C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O

InChI

InChI=1S/C18H33ClN2O5S/c1-5-6-10-7-11(21(3)8-10)17(25)20-12(9(2)19)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,22-24H,5-8H2,1-4H3,(H,20,25)/t9-,10+,11-,12+,13-,14+,15+,16+,18+/m0/s1/i3+1D3

IUPAC

(2S,4R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl]propyl]-4-propyl-1-(trideuterio(1^{13}C)methyl)pyrrolidine-2-carboxamide

Alternate CAS Number

18323-44-9

SIL Type

Carbon, Deuterium

Storage Temperature

-20°C

Shipping Temperature

Blue Ice

Country of Origin

CANADA

Product Type

API; Stable Isotope Labelled

Product Format

Neat

API Family

Clindamycin

Purity

>95% (HPLC)