IUPAC Name: | (6S,8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-6,17-dihydroxy-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-3H-cyclopenta[a]phenanthren-3-one oxime |
Description: | An impurity of Norgestimate, which is an orally active, highly selective progesterone analogue used primarily in oral contraceptives and for the treatment of acne. |
Molecular Weight: | 343.47 |
Molecular Formula: | C21H29NO4 |
Canonical SMILES: | C#C[C@]1(O)CC[C@@]2([H])[C@]3([H])C[C@H](O)C4=CC(CC[C@]4([H])[C@@]3([H])CC[C@]12CC)=NO |
InChI: | InChI=1S/C21H29NO3/c1-3-20-9-7-15-14-6-5-13(22-25)11-17(14)19(23)12-16(15)18(20)8-10-21(20,24)4-2/h2,11,14-16,18-19,23-25H,3,5-10,12H2,1H3/t14-,15-,16-,18+,19+,20+,21+/m1/s1 |
InChI Key: | GRDURFVEBUNOGN-QMSJUBBCSA-N |
Purity: | ≥95% |
Appearance: | White solid |
Storage: | Store at -20 °C |
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