(3Beta)-3-(Acetyloxy)pregna-5,14,16-trien-20-one

cas: 2453-93-2 — see every product listed under this CAS number, including other names

(3Beta)-3-(Acetyloxy)pregna-5,14,16-trien-20-one (CAS 2453-93-2) is a chemical reagent available from Chemat. Available pack sizes: 25mg, 5mg. Offered by: TRC.

brandTRC
catalog numberTRC-A187995-25MG
cas2453-93-2
size25mg
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TRC 25mg price on request
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delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

[(3S,8R,9S,10R,13S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12-octahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate (CAS 2453-93-2) is a chemical compound with the molecular formula C23H30O3 and a molecular weight of 354.5 g/mol. IUPAC name: [(3S,8R,9S,10R,13S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12-octahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate. InChIKey: QLMXZKMIBONXSF-KCRBMJMASA-N.

Identity
Molecular formulaC23H30O3
Molecular weight354.5 g/mol
IUPAC name[(3S,8R,9S,10R,13S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12-octahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
InChIKeyQLMXZKMIBONXSF-KCRBMJMASA-N
SMILESCC(=O)C1=CC=C2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C

Computed by PubChem (NCBI)

Synonyms: Progesterone Impurity 32
Isomers (same molecular formula)
ethyl (2E,4E,6E,8E)-9-(4-methoxy-2,3,6-trimethylphenyl)-3,7-dimethylnona-2,4,6,8-tetraenoate C23H30O3
(4-hexoxyphenyl) 4-butylbenzoate C23H30O3
4-(4-decoxyphenyl)benzoic acid C23H30O3
[(8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-3-oxo-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl] acetate C23H30O3
(8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynylspiro[1,2,4,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-ol C23H30O3
[(8S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl] pentanoate C23H30O3
[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-8,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl] pentanoate C23H30O3
methyl 2-[3-(5-tert-butyl-2-methylphenyl)propyl]-6-methoxybenzoate C23H30O3
(1'R,2'R,3'S,5S,5'S,7'S,10'S,11'R)-7',11'-dimethylspiro[oxolane-5,6'-pentacyclo[8.8.0.02,7.03,5.011,16]octadec-15-ene]-2,14'-dione C23H30O3
(8R,9S,13S,14S)-2-tert-butyl-3-hydroxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-4-carbaldehyde C23H30O3
(8S,13S,14S)-13-ethyl-17-ethynylspiro[1,2,4,6,7,8,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-ol C23H30O3
[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] pentanoate C23H30O3

Also listed as

(3b)-3-(Acetyloxy)pregna-5,14,16-trien-20-one TRC CAS 2453-93-2
(3b)-3-(Acetyloxy)pregna-5,14,16-trien-20-one, 98%, 98% Chemat CAS 2453-93-2
Progesterone Impurity 32, 98% Fluorochem CAS 2453-93-2