Analyte Name

Dexamethasone-delta17,20-d3 21-Aldehyde

Molecular Formula

C22 D3 H24 F O4

Molecular Weight

377.46

Accurate Mass

377.2082

SMILES

[2H]C1=C2C([2H])([2H])C[C@H]3[C@@H]4C[C@@H](C)\C(=C(\O)/C=O)\[C@@]4(C)C[C@H](O)[C@]3(F)[C@@]2(C)C=CC1=O

InChI

InChI=1S/C22H27FO4/c1-12-8-16-15-5-4-13-9-14(25)6-7-21(13,3)22(15,23)18(27)10-20(16,2)19(12)17(26)11-24/h6-7,9,11-12,15-16,18,26-27H,4-5,8,10H2,1-3H3/b19-17-/t12-,15+,16+,18+,20+,21+,22+/m1/s1/i4D2,9D

IUPAC

(2Z)-2-hydroxy-2-[(8S,9R,10S,11S,13S,14S,16R)-4,6,6-trideuterio-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-8,11,12,14,15,16-hexahydro-7H-cyclopenta[a]phenanthren-17-ylidene]acetaldehyde

Unlabelled CAS Number

6762-51-2

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat