Structure Database (LMSD)
Common Name
Ethyltestosterone
Systematic Name
17β-hydroxy-pregn-4-en-3-one
Synonyms
LM ID
LMST02030201
Formula
Exact Mass
Calculate m/z
316.24023
Sum Composition
Status
Active
3D model of Ethyltestosterone
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
FGPGANCDNDLUST-CEGNMAFCSA-N
InChi (Click to copy)
InChI=1S/C21H32O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h13,16-18,23H,4-12H2,1-3H3/t16-,17+,18+,19+,20+,21+/m1/s1
SMILES (Click to copy)
[C@@]12([H])CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@](O)(CC)CC[C@@]21[H]
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
synthetic construct
(#32630)
Dictionary of Steroids: Chemical Data, Structures, and Bibliographies
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
23
Rings
4
Aromatic Rings
0
Rotatable Bonds
1
Van der Waals Molecular Volume
334.72
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
4.95
Molar Refractivity
92.46
Admin
Created at
-
Updated at
20th Mar 2024