Products 1296177-38-2

CAS 1296177-38-2 is the registry number for (6alpha,11beta)-9-Fluoro-6,11,21-trihydroxy-17-(1-oxobutoxy)pregna-1,4-diene-3,20-dione. Offered by: TRC. Available pack sizes: 100mg.

(6alpha,11beta)-9-Fluoro-6,11,21-trihydroxy-17-(1-oxobutoxy)pregna-1,4-diene-3,20-dione
TRC
  • size: 100mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

[(6S,8S,9R,10S,11S,13S,14S,17R)-9-fluoro-6,11-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] butanoate (CAS 1296177-38-2) is a chemical compound with the molecular formula C25H33FO7 and a molecular weight of 464.5 g/mol. IUPAC name: [(6S,8S,9R,10S,11S,13S,14S,17R)-9-fluoro-6,11-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] butanoate. InChIKey: KODYJDILUXBYNG-MXHGPKCJSA-N.

Identity
Molecular formulaC25H33FO7
Molecular weight464.5 g/mol
IUPAC name[(6S,8S,9R,10S,11S,13S,14S,17R)-9-fluoro-6,11-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] butanoate
InChIKeyKODYJDILUXBYNG-MXHGPKCJSA-N
SMILESCCCC(=O)O[C@@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2C[C@@H](C4=CC(=O)C=C[C@@]43C)O)F)O)C)C(=O)CO

Computed by PubChem (NCBI)

Synonyms: (6?,11?)-9-Fluoro-6,11,21-trihydroxy-17-(1-oxobutoxy)pregna-1,4-diene-3,20-dione, KODYJDILUXBYNG-MXHGPKCJSA-N
Isomers (same molecular formula)
(1S,2S,4R,8S,9S,11S,12R,13S)-12-fluoro-11-hydroxy-8-(2-hydroxy-2-methoxyacetyl)-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one C25H33FO7
ethyl [2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] carbonate C25H33FO7
[2-[(1S,2S,4R,8S,9S,11S,12R,13S)-12-fluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-en-8-yl]-2-oxoethyl] formate C25H33FO7