Nombre del analito

2-Methylthio-N6-threonylcarbamoyladenosine-13C,d3

Fórmula molecular

[13C]C15H19D3N6O8S

Peso molecular

462.46

Masa exacta

462.14

SMILES

[2H][13C]([2H])([2H])Sc1nc(NC(=O)N[C@@H]([C@@H](C)O)C(=O)O)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1

InChI

InChI=1S/C16H22N6O8S/c1-5(24)7(14(27)28)18-15(29)19-11-8-12(21-16(20-11)31-2)22(4-17-8)13-10(26)9(25)6(3-23)30-13/h4-7,9-10,13,23-26H,3H2,1-2H3,(H,27,28)(H2,18,19,20,21,29)/t5-,6-,7+,9-,10-,13-/m1/s1/i2+1D3

IUPAC

(2S,3R)-2-[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-(113C)methylsulfanyl-purin-6-yl]carbamoylamino]-3-hydroxy-butanoic Acid

Tipo SIL

Carbon

País de origen

CANADA

Tipo de producto

Stable Isotope Labelled

Formato del producto

Neat