Products 107542-01-8

CAS 107542-01-8 is the registry number for Cyclic Methyl Orthovalerate Cortisone. Offered by: TRC. Available pack sizes: 1g.

Cyclic Methyl Orthovalerate Cortisone
TRC
  • size: 1g
  • Variants: 1
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Structural formula: {0} (CAS {1})

(8S,9S,10R,13S,14S,17R)-2'-butyl-2'-methoxy-10,13-dimethylspiro[1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-17,4'-1,3-dioxane]-3,5',11-trione (CAS 107542-01-8) is a chemical compound with the molecular formula C27H38O6 and a molecular weight of 458.6 g/mol. IUPAC name: (8S,9S,10R,13S,14S,17R)-2'-butyl-2'-methoxy-10,13-dimethylspiro[1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-17,4'-1,3-dioxane]-3,5',11-trione. InChIKey: LHLQMBVZTPVTKF-LGPVFXLISA-N.

Identity
Molecular formulaC27H38O6
Molecular weight458.6 g/mol
IUPAC name(8S,9S,10R,13S,14S,17R)-2'-butyl-2'-methoxy-10,13-dimethylspiro[1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-17,4'-1,3-dioxane]-3,5',11-trione
InChIKeyLHLQMBVZTPVTKF-LGPVFXLISA-N
SMILESCCCCC1(OCC(=O)[C@@]2(O1)CC[C@@H]3[C@@]2(CC(=O)[C@H]4[C@H]3CCC5=CC(=O)CC[C@]45C)C)OC

Computed by PubChem (NCBI)

Synonyms: Cyclic Methyl Orthovalerate Cortisone
Isomers (same molecular formula)
(4R)-4-[(5R,7S,10S,13R,14R,17R)-7-hydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid C27H38O6
(4R,6'S,8'S,9'S,10'R,11'S,13'S,14'S)-2-ethoxy-2-ethyl-11'-hydroxy-6',10',13'-trimethylspiro[1,3-dioxane-4,17'-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene]-3',5-dione C27H38O6