[(8S,9R,10S,11S,13S,14S,17R)-9-fluoranyl-17-(fluoranylmethylselanylcarbonyl)-10,13-dimethyl-16-methylidene-11-oxidanyl-3-oxidanylidene-7,8,11,12,14,15-hexahydro-6H-cyclopenta[a]phenanthren-17-yl] propanoate

Systemtic Name: [(8S,9R,10S,11S,13S,14S,17R)-9-fluoranyl-17-(fluoranylmethylselanylcarbonyl)-10,13-dimethyl-16-methylidene-11-oxidanyl-3-oxidanylidene-7,8,11,12,14,15-hexahydro-6H-cyclopenta[a]phenanthren-17-yl] propanoate Openeye Name: [(8S,9R,10S,11S,13S,14S,17R)-9-fluoro-17-(fluoromethylselanylcarbonyl)-11-hydroxy-10,13-dimethyl-16-methylene-3-oxo-7,8,11,12,14,15-hexahydro-6H-cyclopenta[a]phenanthren-17-yl] propanoate CAS Name: propanoic acid [(8S,9R,10S,11S,13S,14S,17R)-9-fluoro-17-[(fluoromethylseleno)-oxomethyl]-11-hydroxy-10,13-dimethyl-16-methylene-3-oxo-7,8,11,12,14,15-hexahydro-6H-cyclopenta[a]phenanthren-17-yl] ester IUPAC Name: [(8S,9R,10S,11S,13S,14S,17R)-9-fluoro-17-(fluoromethylselanylcarbonyl)-11-hydroxy-10,13-dimethyl-16-methylidene-3-oxo-7,8,11,12,14,15-hexahydro-6H-cyclopenta[a]phenanthren-17-yl] propanoate Traditional Name: propionic acid [(8S,9R,10S,11S,13S,14S,17R)-9-fluoro-17-(fluoromethylseleno)carbonyl-11-hydroxy-3-keto-10,13-dimethyl-16-methylene-7,8,11,12,14,15-hexahydro-6H-cyclopenta[a]phenanthren-17-yl] ester Formula: C25H30F2O5Se MolecularWeight: 527.459506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1(C(=C)CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C)C(=O)[Se]CF

Isomeric SMILES

CCC(=O)O[C@@]1(C(=C)C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)C(=O)[Se]CF

InChI

InChI=1S/C25H30F2O5Se/c1-5-20(30)32-25(21(31)33-13-26)14(2)10-18-17-7-6-15-11-16(28)8-9-22(15,3)24(17,27)19(29)12-23(18,25)4/h8-9,11,17-19,29H,2,5-7,10,12-13H2,1,3-4H3/t17-,18-,19-,22-,23-,24-,25-/m0/s1