Dichlorisone acetate

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Systematic / IUPAC Name: [2-[(8S,9R,10S,11S,13S,14S,17R)-9,11-Dichloro-17-hydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate

ID: Reference2031

Other Names: Dichlorisone 21-acetate;
9α,11β-Dichloro-17α,21-dihydroxypregna-1,4-diene-3,20-dione 21-acetate;
Astroderm;
Cloriderm;
Dermocid ; more

Formula: C23H28Cl2O5

Class: Steroids/Vitamins/Hormones

Spectral Data

Dichlorisone acetate 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 1
No. of Spectra 45
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/16/2015 1:33:14 PM
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Identificators

InChI InChI=1S/C23H28Cl2O5/c1-13(26)30-12-19(28)22(29)9-7-16-17-5-4-14-10-15(27)6-8-20(14,2)23(17,25)18(24)11-21(16,22)3/h6,8,10,16-18,29H,4-5,7,9,11-12H2,1-3H3/t16-,17-,18-,20-,21-,22-,23-/m0/s1
InChI Key YNNURTVKPVJVEI-GSLJADNHSA-N
Canonical SMILES CC(=O)OCC(=O)C1(CCC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)Cl)Cl)C)O
CAS 79618
Splash
Other Names Dichlorisone 21-acetate;
9α,11β-Dichloro-17α,21-dihydroxypregna-1,4-diene-3,20-dione 21-acetate;
Astroderm;
Cloriderm;
Dermocid;
Diloderm;
Disoderm;
Visoderm;
δ1-9,11-Dichlorocortisone acetate;
(11β)-21-(Acetyloxy)-9,11-dichloro-17-hydroxypregna-1,4-diene-3,20-dione;
Pregna-1,4-diene-3,20-dione, 21-(acetyloxy)-9,11-dichloro-17-hydroxy-, (11β)-

In Other Databases

KEGG D07815
ChEMBL CHEMBL1385514
PubChem 5388959
ChemSpider 4534995