5-Pregnen-3beta-ol-20-one-16alpha-carbonitrile

Product Name 5-Pregnen-3beta-ol-20-one-16alpha-carbonitrile

CAS1434-54-4

MFC22H31NO2

MW341.49

InChIInChI=1/C22H31NO2/c1-13(24)20-14(12-23)10-19-17-5-4-15-11-16(25)6-8-21(15,2)18(17)7-9-22(19,20)3/h4,14,16-20,25H,5-11H2,1-3H3/t14-,16-,17+,18-,19-,20-,21-,22-/s3

InChIKeyVSBHRRMYCDQLJF-MWDBKISHNA-N

Smiles[C@@]12([H])C[C@@H](C#N)[C@H](C(=O)C)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@H](O)CC3=CC[C@@]21[H] |&1:0,3,6,10,14,16,20,26,r|

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