13-methyl-11-[4-[6-[4,4,4-tris(fluoranyl)butylsulfinyl]hexoxy]phenyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol

Systemtic Name: 13-methyl-11-[4-[6-[4,4,4-tris(fluoranyl)butylsulfinyl]hexoxy]phenyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol Openeye Name: 13-methyl-11-[4-[6-(4,4,4-trifluorobutylsulfinyl)hexoxy]phenyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol CAS Name: 13-methyl-11-[4-[6-(4,4,4-trifluorobutylsulfinyl)hexoxy]phenyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol IUPAC Name: 13-methyl-11-[4-[6-(4,4,4-trifluorobutylsulfinyl)hexoxy]phenyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol Traditional Name: 13-methyl-11-[4-[6-(4,4,4-trifluorobutylsulfinyl)hexoxy]phenyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol Formula: C34H45F3O4S MolecularWeight: 606.77891

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC(C3C(C1CCC2O)CCC4=C3C=CC(=C4)O)C5=CC=C(C=C5)OCCCCCCS(=O)CCCC(F)(F)F

Isomeric SMILES

CC12CC(C3C(C1CCC2O)CCC4=C3C=CC(=C4)O)C5=CC=C(C=C5)OCCCCCCS(=O)CCCC(F)(F)F

InChI

InChI=1S/C34H45F3O4S/c1-33-22-29(32-27-14-10-25(38)21-24(27)9-13-28(32)30(33)15-16-31(33)39)23-7-11-26(12-8-23)41-18-4-2-3-5-19-42(40)20-6-17-34(35,36)37/h7-8,10-12,14,21,28-32,38-39H,2-6,9,13,15-20,22H2,1H3