Hydrocortisone 17-butyrate

enlarge

Systematic / IUPAC Name: [(8S,9S,10R,11S,13S,14S,17R)-11-Hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] butanoate

ID: Reference2189

Other Names: Cortisol 17-butyrate;
Hydrocortisone butyrate;
Alfason;
Hycortate;
Lacoidon ; more

Formula: C25H36O6

Class: Therapeutics/Prescription Drugs

Spectral Data

Hydrocortisone 17-butyrate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 45
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/4/2015 1:41:22 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C25H36O6/c1-4-5-21(30)31-25(20(29)14-26)11-9-18-17-7-6-15-12-16(27)8-10-23(15,2)22(17)19(28)13-24(18,25)3/h12,17-19,22,26,28H,4-11,13-14H2,1-3H3/t17-,18-,19-,22+,23-,24-,25-/m0/s1
InChI Key BMCQMVFGOVHVNG-TUFAYURCSA-N
Canonical SMILES CCCC(=O)OC1(CCC2C1(CC(C3C2CCC4=CC(=O)CCC34C)O)C)C(=O)CO
CAS 13609671
Splash
Other Names Cortisol 17-butyrate;
Hydrocortisone butyrate;
Alfason;
Hycortate;
Lacoidon;
Laticort;
Bucort;
Hydrocortisone-17α-butyrate;
Lacoid;
17-O-Butyrylcortisol;
11β,17,21-Trihydroxypregn-4-ene-3,20-dione 17-butyrate;
11-β,17-α,21-Trihydroxy-4-pregnene-3,20-dione 17-α-butyrate;
(11β)-11,21-Dihydroxy-17-(1-oxobutoxy)pregn-4-ene-3,20-dione;
11β,21-Dihydroxy-3,20-dioxopregn-4-en-17-yl butanoate;
Pregn-4-ene-3,20-dione, 11,21-dihydroxy-17-(1-oxobutoxy)-, (11β)-

In Other Databases

ChemSpider 24344
ChemIDPlus 013609671
ChEBI CHEBI:31674
PubChem 26133
Wikipedia Hydrocortisone-17-butyrate
ChEMBL CHEMBL1683
KEGG D01619