Products 104948-90-5

CAS 104948-90-5 is the registry number for 2,3,4-Triacetyl Prednisone Glucuronide. Offered by: TRC. Available pack sizes: 100mg.

2,3,4-Triacetyl Prednisone Glucuronide
TRC
  • size: 100mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

Methyl (2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[2-[(10R,13S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]oxane-2-carboxylate (CAS 104948-90-5) is a chemical compound with the molecular formula C34H42O14 and a molecular weight of 674.7 g/mol. IUPAC name: methyl (2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[2-[(10R,13S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]oxane-2-carboxylate. InChIKey: NFXRPGMRHVVSKR-BOOHZBNZSA-N.

Identity
Molecular formulaC34H42O14
Molecular weight674.7 g/mol
IUPAC namemethyl (2R,3R,4R,5S,6S)-3,4,5-triacetyloxy-6-[2-[(10R,13S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]oxane-2-carboxylate
InChIKeyNFXRPGMRHVVSKR-BOOHZBNZSA-N
SMILESCC(=O)O[C@@H]1[C@H]([C@@H](O[C@@H]([C@H]1OC(=O)C)OCC(=O)[C@]2(CCC3[C@@]2(CC(=O)C4C3CCC5=CC(=O)C=C[C@]45C)C)O)C(=O)OC)OC(=O)C

Computed by PubChem (NCBI)

Synonyms: 2,3,4-Triacetyl Prednisone Glucuronide