6β-Hydroxy budesonide

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Systematic / IUPAC Name: 6b-Glycoloyl-5,12-dihydroxy-4a,6a-dimethyl-8-propyl-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]dioxol-2-one

ID: Reference1853

Other Names: (22S)-6α,11β,21-Trihydroxy-16α,17α-propylmethylenedioxypregna-1,4-diene-3,20-dione

Formula: C25H34O7

Class: Therapeutics/Prescription Drugs

Spectral Data

6β-Hydroxy budesonide 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 11/21/2014 10:03:48 AM
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Identificators

InChI InChI=1S/C25H34O7/c1-4-5-21-31-20-10-15-14-9-17(28)16-8-13(27)6-7-23(16,2)22(14)18(29)11-24(15,3)25(20,32-21)19(30)12-26/h6-8,14-15,17-18,20-22,26,28-29H,4-5,9-12H2,1-3H3
InChI Key JBVVDXJXIDYDMF-UHFFFAOYSA-N
Canonical SMILES CCCC1OC2CC3C4CC(C5=CC(=O)C=CC5(C4C(CC3(C2(O1)C(=O)CO)C)O)C)O
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Other Names (22S)-6α,11β,21-Trihydroxy-16α,17α-propylmethylenedioxypregna-1,4-diene-3,20-dione

In Other Databases

PubChem 633586
ChemSpider 550043