Analyte Name

20-Hydroxy Prednisolone-D8

Molecular Formula

C21 D8 H22 O5

Molecular Weight

370.509

Accurate Mass

370.26

SMILES

[2H]C1=C[C@@H]2C(=C([2H])C1=O)C([2H])([2H])C[C@@]3(C)[C@@H]4CC[C@](O)(C(O)CO)[C@@]4(C)C([2H])([2H])[C@]([2H])(O)[C@]23[2H]

InChI

InChI=1S/C21H30O5/c1-19-7-5-12-9-13(23)3-4-14(12)18(19)15(24)10-20(2)16(19)6-8-21(20,26)17(25)11-22/h3-4,9,14-18,22,24-26H,5-8,10-11H2,1-2H3/t14-,15+,16+,17?,18+,19+,20+,21+/m1/s1/i3D,5D2,9D,10D2,15D,18D

IUPAC

(8S,9R,10S,11S,13S,14S,17R)-2,4,6,6,9,11,12,12-octadeuterio-17-(1,2-dihydroxyethyl)-11,17-dihydroxy-8,13-dimethyl-10,14,15,16-tetrahydro-7H-cyclopenta[a]phenanthren-3-one

Unlabelled CAS Number

2782-72-1

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat