Product Code

TRC-C580042

Product Format

Neat

Molecular Formula

C17 D3 H28 Cl N2 O5 S

Molecular Weight

413.975

Product Categories

TRC, Stable isotopes, Pharmaceutical Toxicology Reference Materials

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

18323-43-8

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Clindamycin B-d3

Molecular Formula

C17 D3 H28 Cl N2 O5 S

Molecular Weight

413.975

Accurate Mass

413.183

SMILES

[2H]C([2H])([2H])N1C[C@H](CC)CC1C(=O)N[C@H]([C@H](C)Cl)[C@H]2O[C@H](SC)C(O)C(O)[C@H]2O

InChI

InChI=1S/C17H31ClN2O5S/c1-5-9-6-10(20(3)7-9)16(24)19-11(8(2)18)15-13(22)12(21)14(23)17(25-15)26-4/h8-15,17,21-23H,5-7H2,1-4H3,(H,19,24)/t8-,9+,10?,11+,12?,13+,14?,15+,17+/m0/s1/i3D3

IUPAC

(4R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-4-ethyl-1-(trideuteriomethyl)pyrrolidine-2-carboxamide

Unlabelled CAS Number

18323-43-8

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Clindamycin B-d3

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