Structure Database (LMSD)
Common Name
Epitestosterone
Systematic Name
17α-hydroxyandrost-4-en-3-one
Synonyms
LM ID
LMST02020051
Formula
Exact Mass
Calculate m/z
288.20893
Sum Composition
Status
Curated
3D model of Epitestosterone
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
Biological Context
epi-Testosterone is an analytical reference material categorized as an anabolic androgenic steroid.1 epi-Testosterone has been used as a masking agent for testosterone in sports doping. epi-Testosterone is regulated as a Schedule III compound in the United States. This product is intended for research and forensic applications.
This information has been provided by Cayman Chemical
References
String Representations
InChiKey (Click to copy)
MUMGGOZAMZWBJJ-KZYORJDKSA-N
InChi (Click to copy)
InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14-,15-,16-,17+,18-,19-/m0/s1
SMILES (Click to copy)
C1[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@H](O)CC[C@@]4([H])[C@]3([H])CCC2=CC(=O)C1
Other Databases
Wikipedia
HMDB ID
CHEBI ID
PubChem CID
SwissLipids ID
Cayman ID
PDB ID
Calculated Physicochemical Properties
Heavy Atoms
21
Rings
4
Aromatic Rings
0
Rotatable Bonds
0
Van der Waals Molecular Volume
300.12
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
4.17
Molar Refractivity
83.23
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Created at
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Updated at
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