Analyte Name

5-Fluorotetrahydropyran Clofarabine

CAS Number

1093278-53-5

Molecular Formula

C15 H18 Cl F2 N5 O6

Molecular Weight

437.783

Accurate Mass

437.091

SMILES

OC[C@H]1O[C@@H](Nc2nc(Cl)nc3c2ncn3[C@@H]4O[C@H](CO)[C@@H](O)[C@@H]4F)[C@@H](F)[C@@H]1O

InChI

InChI=1S/C15H18ClF2N5O6/c16-15-21-11(20-13-6(17)9(26)4(1-24)28-13)8-12(22-15)23(3-19-8)14-7(18)10(27)5(2-25)29-14/h3-7,9-10,13-14,24-27H,1-2H2,(H,20,21,22)/t4-,5-,6+,7+,9-,10-,13-,14-/m1/s1

IUPAC

(2R,3R,4S,5R)-5-[[2-chloro-9-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-4-fluoro-2-(hydroxymethyl)oxolan-3-ol

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat