Prednisolone tebutate
CAS Registry Number®
7681-14-3
CAS Name
Prednisolone tebutateMolecular Formula
C27H38O6Molecular Mass
458.59Cite this Page
Prednisolone tebutate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=7114-05-8 (retrieved ) (CAS RN: 7681-14-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
266-273 °C
Source(s)
- (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)
Other Names and Identifiers
InChI
InChI=1S/C27H38O6/c1-24(2,3)14-22(31)33-15-21(30)27(32)11-9-19-18-7-6-16-12-17(28)8-10-25(16,4)23(18)20(29)13-26(19,27)5/h8,10,12,18-20,23,29,32H,6-7,9,11,13-15H2,1-5H3/t18-,19-,20-,23+,25-,26-,27-/m0/s1
InChIKey
InChIKey=HUMXXHTVHHLNRO-KAJVQRHHSA-N
SMILES
C[C@@]12[C@]([C@]3([C@]([C@@H](O)C1)([C@]4(C)C(CC3)=CC(=O)C=C4)[H])[H])(CC[C@@]2(C(COC(CC(C)(C)C)=O)=O)O)[H]
Canonical SMILES
O=C1C=CC2(C(=C1)CCC3C4CCC(O)(C(=O)COC(=O)CC(C)(C)C)C4(C)CC(O)C32)C
Other Names for this Substance
- Pregna-1,4-diene-3,20-dione, 21-(3,3-dimethyl-1-oxobutoxy)-11,17-dihydroxy-, (11β)-
- Pregna-1,4-diene-3,20-dione, 11β,17,21-trihydroxy-, 21-(3,3-dimethylbutyrate)
- Butyric acid, 3,3-dimethyl-, 21-ester with 11β,17,21-trihydroxypregna-1,4-diene-3,20-dione
- (11β)-21-(3,3-Dimethyl-1-oxobutoxy)-11,17-dihydroxypregna-1,4-diene-3,20-dione
- Prednisolone 21-tert-butylacetate
Deleted or Replaced CAS Registry Numbers
7114-05-8