16Alpha,17,21-Trihydroxy-pregna-1,4-diene-3,11,20-trione

CAS: 3754-05-0

Ref. TR-T795230

Product Information

• Name: 16Alpha,17,21-Trihydroxy-pregna-1,4-diene-3,11,20-trione
• Synonyms: Pregna-1,4-diene-3,11,20-trione, 16,17,21-trihydroxy-, (16α)- (ACI), (16α)-16,17,21-Trihydroxypregna-1,4-diene-3,11,20-trione (ACI), Pregna-1,4-diene-3,11,20-trione, 16α,17,21-trihydroxy- (6CI, 7CI, 8CI), 16α-Hydroxy-11-keto Prednisolone, (8S,9S,10R,13S,14S,16R,17S)-16,17-Dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,10,12,13,14,15,16,17-decahydro-3H-cyclopenta[a]phenanthrene-3,11(6H)-dione), 16α,17,21-Trihydroxypregna-1,4-diene-3,11,20-trione
• Brand: TRC

Description

Applications A metabolite of Budesonide (B689490), an antiinflammatory agent.
References Cserhati, T., et al.: J. Pharm. Biomed. Anal., 22, 25 (2000), Dilger, K., et al.: J. Clin. Pharmacol., 47, 1532 (2007), Buchwald, P., et al.: Steroids, 73, 193 (2008),

Chemical properties

• Molecular weight: 374.43
• Formula: C₂₁H₂₆O₆
• Color/Form: Neat
• InChI: InChI=1S/C21H26O6/c1-19-6-5-12(23)7-11(19)3-4-13-14-8-16(25)21(27,17(26)10-22)20(14,2)9-15(24)18(13)19/h5-7,13-14,16,18,22,25,27H,3-4,8-10H2,1-2H3/t13-,14-,16+,18+,19-,20-,21-/m0/s1
• InChI key: InChIKey=QUDYJOZZUZDXCV-QLONCABFSA-N
• SMILES: C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1C[C@@H](O)[C@]2(O)C(=O)CO