RefMet Compound Details

MW structure35394 (View MW Metabolite Database details)
RefMet nameCortisone
Systematic name17alpha,21-dihydroxypregn-4-ene-3,11,20-trione
Canonical SMILESC[C@@]12CCC(=O)C=C1CC[C@H]1[C@H]2C(=O)C[C@]2(C)[C@@H]1CC[C@@]2(O)C(=O)CO
Exact mass360.1937View other entries in RefMet with this exact mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC21H28O5View other entries in RefMet with this formula
InChIInChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1
InChIKeyMFYSYFVPBJMHGN-ZPOLXVRWSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassSterol Lipids
Main ClassSteroids
Sub classC21 steroids
Pubchem CID222786

Table of KEGG reactions in human pathways involving Cortisone

Rxn IDKEGG ReactionEnzyme
R02836 Cortisol + NADP+ <=> Cortisone + NADPH + H+Cortisol:NADP+ 11-oxidoreductase
R02834 Cortisol + NAD+ <=> Cortisone + NADH + H+Cortisol:NAD+ 11-oxidoreductase

Table of KEGG human pathways containing Cortisone

Pathway IDHuman Pathway# of reactions
hsa00140 Steroid hormone biosynthesis 2
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