(8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-5',5'-dimethyl-spiro[1,2,4,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxane]-17-ol

Systemtic Name: (8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-5',5'-dimethyl-spiro[1,2,4,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxane]-17-ol Openeye Name: (8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-5',5'-dimethyl-spiro[1,2,4,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxane]-17-ol CAS Name: (8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-5',5'-dimethyl-17-spiro[1,2,4,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxane]ol IUPAC Name: (8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-5',5'-dimethylspiro[1,2,4,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxane]-17-ol Traditional Name: (8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-5',5'-dimethyl-spiro[1,2,4,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxane]-17-ol Formula: C26H36O3 MolecularWeight: 396.56224

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CCC3C4CCC5(CC4=CCC3C1C=CC2(C#C)O)OCC(CO5)(C)C

Isomeric SMILES

CC[C@]12CC[C@@H]3[C@H]4CCC5(CC4=CC[C@H]3[C@@H]1C=C[C@]2(C#C)O)OCC(CO5)(C)C

InChI

InChI=1S/C26H36O3/c1-5-24-12-9-20-19-10-14-26(28-16-23(3,4)17-29-26)15-18(19)7-8-21(20)22(24)11-13-25(24,27)6-2/h2,7,11,13,19-22,27H,5,8-10,12,14-17H2,1,3-4H3/t19-,20+,21+,22-,24-,25-/m0/s1