Analyte Name

Amino-Pimonidazole Glutathione Conjugate-d10

Molecular Formula

C21H25D10N7O7S

Molecular Weight

539.67

Accurate Mass

539.29

SMILES

OC(CN1C(SCC(C(NCC(O)=O)=O)NC(CCC(N)C(O)=O)=O)=CN=C1N)CN2C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C2([2H])[2H].OC(CN3C=C(SCC(C(NCC(O)=O)=O)NC(CCC(N)C(O)=O)=O)N=C3N)CN4C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C4([2H])[2H]

InChI

InChI=1S/2C21H35N7O7S/c22-14(20(34)35)4-5-16(30)26-15(19(33)24-9-18(31)32)12-36-17-8-25-21(23)28(17)11-13(29)10-27-6-2-1-3-7-27;22-14(20(34)35)4-5-16(30)25-15(19(33)24-8-18(31)32)12-36-17-11-28(21(23)26-17)10-13(29)9-27-6-2-1-3-7-27/h8,13-15,29H,1-7,9-12,22H2,(H2,23,25)(H,24,33)(H,26,30)(H,31,32)(H,34,35);11,13-15,29H,1-10,12,22H2,(H2,23,26)(H,24,33)(H,25,30)(H,31,32)(H,34,35)/i2*1D2,2D2,3D2,6D2,7D2

IUPAC

N5-(3-((2-amino-1-(2-hydroxy-3-(piperidin-1-yl-d10)propyl)-1H-imidazol-4-yl)thio)-1-((carboxymethyl)amino)-1-oxopropan-2-yl)glutamine--N5-(3-((2-amino-1-(2-hydroxy-3-(piperidin-1-yl-d10)propyl)-1H-imidazol-5-yl)thio)-1-((carboxymethyl)amino)-1-oxopropan-2-yl)glutamine (1/1)

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat