Analyte Name

Teopranitol-d6

Molecular Formula

C16 D6 H16 N6 O7

Molecular Weight

416.419

Accurate Mass

416.193

SMILES

[2H]C([2H])(N[C@H]1CO[C@@H]2[C@H](CO[C@H]12)O[N+](=O)[O-])C([2H])([2H])C([2H])([2H])n3cnc4N(C)C(=O)N(C)C(=O)c34

InChI

InChI=1S/C16H22N6O7/c1-19-14-11(15(23)20(2)16(19)24)21(8-18-14)5-3-4-17-9-6-27-13-10(29-22(25)26)7-28-12(9)13/h8-10,12-13,17H,3-7H2,1-2H3/t9-,10-,12+,13+/m0/s1/i3D2,4D2,5D2

IUPAC

[(3S,3aR,6S,6aS)-3-[[1,1,2,2,3,3-hexadeuterio-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)propyl]amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate

Unlabelled CAS Number

81792-35-0

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat