Catalog Number:
AG004L44
Chemical Name:
3(R,S)-Hydroxy Desogestrel
CAS Number:
869627-85-0
Molecular Formula:
C22H30O2
Molecular Weight:
326.4724
MDL Number:
MFCD10565982
IUPAC Name:
(8S,10R,13S)-13-ethyl-17-ethynyl-11-methylidene-1,2,3,6,7,8,9,10,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol
InChI:
InChI=1S/C22H30O2/c1-4-21-13-14(3)20-17-9-7-16(23)12-15(17)6-8-18(20)19(21)10-11-22(21,24)5-2/h2,12,16-20,23-24H,3-4,6-11,13H2,1H3/t16?,17-,18-,19?,20?,21-,22?/m0/s1
InChI Key:
ZMLDTNLDYRJTAZ-MTRZUGBVSA-N
SMILES:
C#CC1(O)CCC2[C@]1(CC)CC(=C)C1[C@H]2CCC2=CC(CC[C@H]12)O
