21-Desacetyl deflazacort

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Systematic / IUPAC Name: 6b-Glycoloyl-5-hydroxy-4a,6a,8-trimethyl-4a,4b,5,6,6a,6b,9a,10,10a,10b,11,12-dodecahydro-2H-naphtho[2',1':4,5]indeno[1,2-d-][1,3]oxazol-2-one

ID: Reference1863

Other Names:

Formula: C23H29NO5

Class: Therapeutics/Prescription Drugs

Spectral Data

21-Desacetyl deflazacort 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 39
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/24/2014 1:56:07 PM
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Identificators

InChI InChI=1S/C23H29NO5/c1-12-24-23(18(28)11-25)19(29-12)9-16-15-5-4-13-8-14(26)6-7-21(13,2)20(15)17(27)10-22(16,23)3/h6-8,15-17,19-20,25,27H,4-5,9-11H2,1-3H3
InChI Key KENSGCYKTRNIST-UHFFFAOYSA-N
Canonical SMILES CC1=NC2(C(O1)CC3C2(CC(C4C3CCC5=CC(=O)C=CC45C)O)C)C(=O)CO
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Other Names

In Other Databases

PubChem 631051
ChemSpider 547974