Products 100737-95-9

CAS 100737-95-9 is the registry number for 13-Ethyl-17-hydroxy-18,19-dinor-17alpha-pregn-5-en-20-yn-3-one Cyclic Ethylene Acetal. Offered by: TRC. Available pack sizes: 2,5g.

13-Ethyl-17-hydroxy-18,19-dinor-17alpha-pregn-5-en-20-yn-3-one Cyclic Ethylene Acetal
TRC
  • size: 2,5g
  • Variants: 1
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Structural formula: {0} (CAS {1})

(8R,9S,13S,14S,17R)-13-ethyl-17-ethynylspiro[1,2,4,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-ol (CAS 100737-95-9) is a chemical compound with the molecular formula C23H32O3 and a molecular weight of 356.5 g/mol. IUPAC name: (8R,9S,13S,14S,17R)-13-ethyl-17-ethynylspiro[1,2,4,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-ol. InChIKey: NXUGHQNPMUULBJ-HQSVKEIBSA-N.

Identity
Molecular formulaC23H32O3
Molecular weight356.5 g/mol
IUPAC name(8R,9S,13S,14S,17R)-13-ethyl-17-ethynylspiro[1,2,4,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-ol
InChIKeyNXUGHQNPMUULBJ-HQSVKEIBSA-N
SMILESCC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CC=C4C3CCC5(C4)OCCO5

Computed by PubChem (NCBI)

Isomers (same molecular formula)
[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] pentanoate C23H32O3
[(8R,9S,13S,14S,17R)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] pentanoate C23H32O3
[(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] pentanoate C23H32O3
[(3S,8R,9S,10R,13S,14S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate C23H32O3
[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] 2,2,3,3,4,4,5,5,5-nonadeuteriopentanoate C23H32O3
(7R,8R,9S,13S,14S,17R)-17-ethynyl-7,13-dimethylspiro[1,2,4,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-ol C23H32O3
[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] 3-methylbutanoate C23H32O3