3-Hydroxyestra-1,3,5(10),9(11)-tetraen-17beta-yl Pentanoate (9,11-Didehydroestradiol Valerate)

cas: 95959-20-9 — see every product listed under this CAS number, including other names

3-Hydroxyestra-1,3,5(10),9(11)-tetraen-17beta-yl Pentanoate (9,11-Didehydroestradiol Valerate) (CAS 95959-20-9) is a chemical reagent available from Chemat. Available pack sizes: 100mg, 25mg. Offered by: Mikromol.

• 2D
• 3D

[(8S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl] pentanoate (CAS 95959-20-9) is a chemical compound with the molecular formula C23H30O3 and a molecular weight of 354.5 g/mol. IUPAC name: [(8S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl] pentanoate. InChIKey: JBBVWVSEQQRIJR-FBPBVXOASA-N.

Identity

Molecular formula	C23H30O3
Molecular weight	354.5 g/mol
IUPAC name	[(8S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl] pentanoate
InChIKey	JBBVWVSEQQRIJR-FBPBVXOASA-N
SMILES	CCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC=C3[C@H]2CCC4=C3C=CC(=C4)O)C

Computed by PubChem (NCBI)

Synonyms: 3-Hydroxyestra-1,3,5(10),9(11)-tetraen-17beta-yl pentanoate, Estradiol valerate impurity C [EP], delta9,11-Dehydro-17beta-estradiol 17-valerate, Estra-1,3,5(10),9(11)-tetraene-3,17-diol, 17-pentanoate, (17beta)-, ESTRADIOL VALERATE IMPURITY C [EP IMPURITY], ESTRADIOL VALERATE IMPURITY C (EP IMPURITY), Estradiol Valerate Impurity C, Estradiol Valerate EP Impurity C, 9,11-Dehydro-17beta-estradiol 17-valerate, delta-9(11)-Estradiol-17b-Valerate

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

[(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

ethyl (2E,4E,6E,8E)-3,7-dimethyl-9-[2,3,6-trimethyl-4-(trideuteriomethoxy)phenyl]nona-2,4,6,8-tetraenoate C₂₃H₃₀O₃