Nombre del analito

3-(4-(2-((6-amino-9-((2R,3R,4S,5S)-3,4-dihydroxy-5-(1,1,2,2,2-pentadeuterioethylcarbamoyl)oxolan-2-yl)purin-2-yl)amino)ethyl)phenyl)propanoic acid hydrochloride

Fórmula molecular

C23 D5 H24 N7 O6 . H Cl

Peso molecular

541.011

Masa exacta

540.226

SMILES

Cl.[2H]C([2H])([2H])C([2H])([2H])NC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(N)nc(NCCc4ccc(CCC(=O)O)cc4)nc23

InChI

InChI=1S/C23H29N7O6.ClH/c1-2-25-21(35)18-16(33)17(34)22(36-18)30-11-27-15-19(24)28-23(29-20(15)30)26-10-9-13-5-3-12(4-6-13)7-8-14(31)32;/h3-6,11,16-18,22,33-34H,2,7-10H2,1H3,(H,25,35)(H,31,32)(H3,24,26,28,29);1H/t16-,17+,18-,22+;/m0./s1/i1D3,2D2;

IUPAC

3-[4-[2-[[6-amino-9-[(2R,3R,4S,5S)-3,4-dihydroxy-5-(1,1,2,2,2-pentadeuterioethylcarbamoyl)oxolan-2-yl]purin-2-yl]amino]ethyl]phenyl]propanoic acid;hydrochloride

Tipo SIL

Deuterium

País de origen

CANADA

Tipo de producto

Stable Isotope Labelled

Formato del producto

Neat