Clostebol

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Systematic / IUPAC Name: (17β)-4-Chloro-17-hydroxyandrost-4-en-3-one

ID: Reference8404

Other Names: 4-Chlorotestosterone;
(8R,9S,10R,13S,14S,17S)-4-Chloro-17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one;
4-Chloro-17β-hydroxyandrost-4-en-3-one

Formula: C19H27ClO2

Class: Therapeutics/Prescription Drugs Sports Doping Drugs

Spectral Data

Clostebol 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 Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 138
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/3/2018 12:03:03 PM
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Identificators

InChI InChI=1S/C19H27ClO2/c1-18-10-8-15(21)17(20)14(18)4-3-11-12-5-6-16(22)19(12,2)9-7-13(11)18/h11-13,16,22H,3-10H2,1-2H3/t11-,12-,13-,16-,18+,19-/m0/s1
InChI Key KCZCIYZKSLLNNH-FBPKJDBXSA-N
Canonical SMILES CC12CCC3C(C1CCC2O)CCC4=C(C(=O)CCC34C)Cl
CAS 1093589
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Other Names 4-Chlorotestosterone;
(8R,9S,10R,13S,14S,17S)-4-Chloro-17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one;
4-Chloro-17β-hydroxyandrost-4-en-3-one

In Other Databases

Wikipedia Clostebol
PubChem 68947
ChemSpider 62171
ChEMBL CHEMBL2106571
ChemIDPlus 001093589
DrugBank DB01521
KEGG D07731
Cayman 21168