Systematic / IUPAC Name: (6α)-17,20,21-Trihydroxy-6-methylpregna-1,4-diene-3,11-dione
ID: Reference7179
Other Names: Pregna-1,4-diene-3,11-dione, 17,20,21-trihydroxy-6-methyl-, (6α)-
Formula: C22H30O5
Class: Therapeutics/Prescription Drugs
20-Dihydro 6α-methylprednisone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Orbitrap |
No. of Spectral Trees | 2 |
No. of Spectra | 270 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 12/14/2017 7:05:11 AM |
InChI | InChI=1S/C22H30O5/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,9,12,14-15,18-19,23,26-27H,5,7-8,10-11H2,1-3H3/t12-,14-,15-,18?,19+,20-,21-,22-/m0/s1 |
InChI Key | BGNNNDQIXPRQCW-HSSWZHAFSA-N |
Canonical SMILES | CC1CC2C3CCC(C3(CC(=O)C2C4(C1=CC(=O)C=C4)C)C)(C(CO)O)O |
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Other Names | Pregna-1,4-diene-3,11-dione, 17,20,21-trihydroxy-6-methyl-, (6α)- |