Products 4003-93-4

CAS 4003-93-4 is the registry number for 3Beta,5Beta-Tetrahydro Cortisone 3,21-Diacetate. Offered by: TRC. Available pack sizes: 100mg, 10mg.

3Beta,5Beta-Tetrahydro Cortisone 3,21-Diacetate
TRC
  • size: 100mg, 10mg
  • Variants: 2
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Structural formula: {0} (CAS {1})

[2-[(3S,5R,8S,9S,10S,13S,14S,17R)-3-acetyloxy-17-hydroxy-10,13-dimethyl-11-oxo-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate (CAS 4003-93-4) is a chemical compound with the molecular formula C25H36O7 and a molecular weight of 448.5 g/mol. IUPAC name: [2-[(3S,5R,8S,9S,10S,13S,14S,17R)-3-acetyloxy-17-hydroxy-10,13-dimethyl-11-oxo-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate. InChIKey: PXQRJZNDFRAFTF-JWGYNNGLSA-N.

Identity
Molecular formulaC25H36O7
Molecular weight448.5 g/mol
IUPAC name[2-[(3S,5R,8S,9S,10S,13S,14S,17R)-3-acetyloxy-17-hydroxy-10,13-dimethyl-11-oxo-2,3,4,5,6,7,8,9,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
InChIKeyPXQRJZNDFRAFTF-JWGYNNGLSA-N
SMILESCC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C)O

Computed by PubChem (NCBI)

Synonyms: 3b,5b-Tetrahydro Cortisone 3,21-Diacetate, 3Beta,5Beta-Tetrahydro Cortisone 3,21-Diacetate, 3beta,17,21-Trihydroxy-5beta-pregnane-11,20-dione 3,21-Diacetate
Isomers (same molecular formula)
(2R,4S,4aR,5S,6S)-4-[2,2-bis(trideuteriomethyl)butanoyloxy]-5-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-6-methyl-2,3,4,4a,5,6-hexahydronaphthalene-2-carboxylic acid C25H36O7