Analyte Name

((1S,2R)-3-(((4-Nitrophenyl)sulfonyl)(2-methylpropyl)amino-2-hydroxy-1-phenylmethyl)propyl)carbamic Acid, (3S)-Tetrahydro-3-furan-d4-yl Ester

CAS Number

1217700-81-6

Molecular Formula

C25H29D4N3O8S

Molecular Weight

539.63

Accurate Mass

539.2239

SMILES

[2H]C1([2H])C[C@H](OC(=O)N[C@@H](Cc2ccccc2)[C@H](O)CN(CC(C)C)S(=O)(=O)c3ccc(cc3)[N+](=O)[O-])C([2H])([2H])O1

InChI

InChI=1S/C25H33N3O8S/c1-18(2)15-27(37(33,34)22-10-8-20(9-11-22)28(31)32)16-24(29)23(14-19-6-4-3-5-7-19)26-25(30)36-21-12-13-35-17-21/h3-11,18,21,23-24,29H,12-17H2,1-2H3,(H,26,30)/t21-,23-,24+/m0/s1/i13D2,17D2

IUPAC

[(3S)-2,2,5,5-tetradeuteriooxolan-3-yl] N-[(2S,3R)-3-hydroxy-4-[2-methylpropyl-(4-nitrophenyl)sulfonylamino]-1-phenylbutan-2-yl]carbamate

Unlabelled CAS Number

160231-69-6

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat