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6(Alpha/Beta)-Hydroxymethyl Megestrol Acetate (Megestrol Acetate Impurity) (Mixture of Diastereomers)

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For Research Use Only | Not For Clinical Use
CATAPS004917
SynonymsMegestrol Acetate Impurity,(6α/6β)-17-(Acetyloxy)-6-(hydroxymethyl)pregn-4-ene-3,20-dione
IUPAC Name[(8R,9S,10R,13S,14S,17R)-17-acetyl-6-(hydroxymethyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate
Molecular Weight402.52
Molecular FormulaC24H34O5
Canonical SMILESCC(=O)O[C@@]1(CC[C@H]2[C@@H]3CC(CO)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(=O)C
InChIInChI=1S/C24H34O5/c1-14(26)24(29-15(2)27)10-7-20-18-11-16(13-25)21-12-17(28)5-8-22(21,3)19(18)6-9-23(20,24)4/h12,16,18-20,25H,5-11,13H2,1-4H3/t16?,18-,19+,20+,22-,23+,24+/m1/s1
Accurate Mass402.2406
FormatNeat
SubcategoryImpurity standards
TypeImpurity
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