Prednisolone tebutate

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Systematic / IUPAC Name: (11β)-11,17-Dihydroxy-3,20-dioxopregna-1,4-dien-21-yl 3,3-dimethylbutanoate

ID: Reference7174

Other Names: Hydeltra-T B A;
Predalone T B A;
{2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl} 3,3-dimethylbutanoate ;
11β,17,21-Trihydroxypregna-1,4-diene-3,20-dione 21-(3,3-dimethylbutyrate);
Prednisolone 21-tert-butylacetate ; more

Formula: C27H38O6

Class: Therapeutics/Prescription Drugs Sports Doping Drugs Steroids/Vitamins/Hormones

Spectral Data

Prednisolone tebutate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 118
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/13/2017 2:11:17 PM
View Mass Spec Data > >

Identificators

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
InChI Key HUMXXHTVHHLNRO-KAJVQRHHSA-N
Canonical SMILES CC12CC(C3C(C1CCC2(C(=O)COC(=O)CC(C)(C)C)O)CCC4=CC(=O)C=CC34C)O
CAS 7681143
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Other Names Hydeltra-T B A;
Predalone T B A;
{2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl} 3,3-dimethylbutanoate ;
11β,17,21-Trihydroxypregna-1,4-diene-3,20-dione 21-(3,3-dimethylbutyrate);
Prednisolone 21-tert-butylacetate;
Prednisolone butyl acetete;
Prednisolone butylacetate;
Pregna-1,4-diene-3,20-dione, 11,17-dihydroxy-21-[(3,3-dimethyl-1-oxobutyl)oxy]-, (11β)- ;
Pregna-1,4-diene-3,20-dione, 21-(3,3-dimethyl-1-oxobutoxy)-11,17-dihydroxy-, (11β)-

In Other Databases

ChemIDPlus 007681143
ChemSpider 84007
PubChem 93055
ChEBI CHEBI:8381
ChEMBL CHEMBL1200909
KEGG C08182; D00982