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Dexamethasone-d5

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For Research Use Only | Not For Clinical Use
CATAPS358731916
CAS358731-91-6
Structure
IUPAC Name(8S,9R,10S,11S,13S,14S,16R,17R)-4,6,6-trideuterio-17-(2,2-dideuterio-2-hydroxyacetyl)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-8,11,12,14,15,16-hexahydro-7H-cyclopenta[a]phenanthren-3-one
Molecular Weight397.49
Molecular FormulaC222H5H24FO5
Canonical SMILES[2H]C1=C2C([2H])([2H])C[C@H]3[C@@H]4C[C@@H](C)[C@](O)(C(=O)C([2H])([2H])O)[C@@]4(C)C[C@H](O)[C@]3(F)[C@@]2(C)C=CC1=O
InChIInChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1/i4D2,9D,11D2
Accurate Mass397.2313
FormatNeat
TypeStable Isotope Labelled
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