Product Code

TRC-G305007

Product Format

Neat

Molecular Formula

C9 H12 F2 15N3 O7 P

Molecular Weight

346.158

Product Categories

TRC, Stable isotopes

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

116371-67-6

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Gemcitabine Monophosphate-15N3

Molecular Formula

C9 H12 F2 15N3 O7 P

Molecular Weight

346.158

Accurate Mass

346.029

SMILES

[15NH2]C1=[15N]C(=O)[15N](C=C1)[C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)C2(F)F

InChI

InChI=1S/C9H12F2N3O7P/c10-9(11)6(15)4(3-20-22(17,18)19)21-7(9)14-2-1-5(12)13-8(14)16/h1-2,4,6-7,15H,3H2,(H2,12,13,16)(H2,17,18,19)/t4-,6-,7-/m1/s1/i12+1,13+1,14+1

IUPAC

[(2R,3R,5R)-5-(4-(15N)azanyl-2-oxo(1,3-15N2)pyrimidin-1-yl)-4,4-difluoro-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate

Unlabelled CAS Number

116371-67-6

SIL Type

Nitrogen

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Gemcitabine Monophosphate-15N3

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