Structure Database (LMSD)
Common Name
19-oxo-testosterone
Systematic Name
17β-hydroxyandrost-4-en-3,19-dione
Synonyms
LM ID
LMST02020145
Formula
Exact Mass
Calculate m/z
302.188195
Sum Composition
Status
Curated
3D model of 19-oxo-testosterone
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
Reactions
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Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
Click on an edge to display the reaction(s).

References
String Representations
InChiKey (Click to copy)
TXNCGXATKOMEQC-KOUJMVCDSA-N
InChi (Click to copy)
InChI=1S/C19H26O3/c1-18-8-7-16-14(15(18)4-5-17(18)22)3-2-12-10-13(21)6-9-19(12,16)11-20/h10-11,14-17,22H,2-9H2,1H3/t14-,15-,16-,17-,18-,19+/m0/s1
SMILES (Click to copy)
[C@@]12(C=O)[C@@]3([H])CC[C@]4(C)[C@@H](O)CC[C@@]4([H])[C@]3([H])CCC1=CC(=O)CC2
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
22
Rings
4
Aromatic Rings
Rotatable Bonds
1
Van der Waals Molecular Volume
306.27
Topological Polar Surface Area
54.37
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
logP
3.34
Molar Refractivity
83.62
Admin
Created at
29th Nov 2023
Updated at
29th Nov 2023