6alpha-Fluoro-17beta-hydroxyandrost-4-en-3-one propionate

Properties Image MNX_ID MNXM38971 reference chebi:79823 formula C22H31FO3 global charge 0 mol weight 362.485 InChIKey GACKBTMUYYITHY-BQPCAVHVSA-N InChI InChI=1S/C22H31FO3/c1-4-20(25)26-19-6-5-15-14-12-18(23)17-11-13(24)7-9-21(17,2)16(14)8-10-22(15,19)3/h11,14-16,18-19H,4-10,12H2,1-3H3/t14-,15-,16-,18-,19-,21+,22-/m0/s1 SMILES CCC(=O)O[C@H]1CC[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C MNX internals InChI (mnx) InChI=1/C22H31FO3/c1-4-20(25)26-19-6-5-15-14-12-18(23)17-11-13(24)7-9-21(17,2)16(14)8-10-22(15,19)3/h11,14-16,18-19H,4-10,12H2,1-3H3/t14-,15-,16-,18-,19-,21+,22-/m0/s1 SMILES (mnx) [CH3:1][CH2:4][C:20](=[O:25])[O:26][C@H:19]1[CH2:6][CH2:5][C@H:15]2[C@@H:14]3[CH2:12][C@H:18]([F:23])[C:17]4=[CH:11][C:13](=[O:24])[CH2:7][CH2:9][C@:21]4([CH3:2])[C@H:16]3[CH2:8][CH2:10][C@@:22]21[CH3:3]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0