(1S,9bR)-9b-fluoro-1,5,10-trihydroxy-1,9a,11a-trimethyl-2H,3H,3aH,3bH,4H,5H,8H,9H,10H,11H-cyclopenta[a]phenanthren-7-one

Properties Image MNX_ID MNXM747082 reference chebi:143314 formula C20H29FO4 global charge 0 mol weight 352.446 InChIKey SAMKMXPGYNTUIZ-RMEHYIQSSA-N InChI InChI=1S/C20H29FO4/c1-17-6-4-11(22)8-14(17)15(23)9-13-12-5-7-19(3,25)18(12,2)10-16(24)20(13,17)21/h8,12-13,15-16,23-25H,4-7,9-10H2,1-3H3/t12?,13?,15?,16?,17?,18?,19-,20-/m0/s1 SMILES CC12CCC(=O)C=C1C(O)CC1C3CC[C@](C)(O)C3(C)CC(O)[C@@]12F MNX internals InChI (mnx) InChI=1/C20H29FO4/c1-17-6-4-11(22)8-14(17)15(23)9-13-12-5-7-19(3,25)18(12,2)10-16(24)20(13,17)21/h8,12-13,15-16,23-25H,4-7,9-10H2,1-3H3/t12?,13?,15?,16?,17?,18?,19-,20-/m0/s1 SMILES (mnx) [CH3:1][C:17]12[CH2:6][CH2:4][C:11](=[O:22])[CH:8]=[C:14]1[CH:15]([OH:23])[CH2:9][CH:13]1[CH:12]3[CH2:5][CH2:7][C@:19]([CH3:3])([OH:25])[C:18]3([CH3:2])[CH2:10][CH:16]([OH:24])[C@@:20]12[F:21]

Parent-child relations graph

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