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17Alpha,21-Dihydroxy-16Alpha-methyl-1,4-pregnadiene-3,20-dione

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For Research Use Only | Not For Clinical Use
CATAPS19784873
CAS19784-87-3
Structure
Synonyms17,21-Dihydroxy-16α-methyl-pregna-1,4-diene-3,20-dione,(16α)-17,21-Dihydroxy-16-methylpregna-1,4-diene-3,20-dione
IUPAC Name(8R,9S,10R,13S,14S,16R,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one
Molecular Weight358.47
Molecular FormulaC22H30O4
Canonical SMILESC[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]2(C)[C@@]1(O)C(=O)CO
InChIInChI=1S/C22H30O4/c1-13-10-18-16-5-4-14-11-15(24)6-8-20(14,2)17(16)7-9-21(18,3)22(13,26)19(25)12-23/h6,8,11,13,16-18,23,26H,4-5,7,9-10,12H2,1-3H3/t13-,16-,17+,18+,20+,21+,22+/m1/s1
Accurate Mass358.2144
FormatNeat
SubcategorySteroids and derivatives, Dexamethasone and derivatives
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