RefMet Compound Details

MW structure39031 (View MW Metabolite Database details)
RefMet nameAdrenosterone
Systematic name(1S,2R,10S,11S,15S)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-ene-5,14,17-trione
SMILESC[C@]12CCC(=O)C=C1CC[C@H]1[C@@H]3CCC(=O)[C@@]3(C)CC(=O)[C@H]21   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass300.172545 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC19H24O3View other entries in RefMet with this formula
InChIInChI=1S/C19H24O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h9,13-14,17H,3-8,10H2,1-2H3/t13-,14-,17+,1
8-,19-/m0/s1
InChIKeyRZRPTBIGEANTGU-IRIMSJTPSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassSterol Lipids
Main ClassSteroids
Sub ClassC19 Steroids
Pubchem CID223997
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving Adrenosterone

Rxn IDKEGG ReactionEnzyme
R04758 11beta-Hydroxyandrost-4-ene-3,17-dione + NADP+ <=> Adrenosterone + NADPH + H+11beta-Hydroxyandrost-4-ene-3,17-dione:NADP+ 11-oxidoreductase

Table of KEGG human pathways containing Adrenosterone

Pathway IDHuman Pathway# of reactions
hsa00140 Steroid hormone biosynthesis 1
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