Structure Database (LMSD)

Common Name
7alpha-Hydroxytestosterone
Systematic Name
7α,17β-dihydroxyandrost-4-en-3-one
Synonyms
LM ID
LMST02020068
Status
Active
Exact Mass
Calculate m/z
304.203845
Formula
Abbrev


Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
RNCGWYKXAJCOLD-JUKXBMAYSA-N
InChi (Click to copy)
InChI=1S/C19H28O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h9,13-17,21-22H,3-8,10H2,1-2H3/t13-,14-,15+,16-,17-,18-,19-/m0/s1
SMILES (Click to copy)
[C@]12([H])CC[C@]3(C)[C@H](CC[C@@]3([H])[C@]1([H])[C@H](O)CC1=CC(CC[C@]21C)=O)O

References

Reference
7-Alpha-hydroxytestosterone in seminiferous tubules of rat testis.
Arch Androl, 1983
DOI: 10.3109/01485018308990170
PMID: 6573875

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Rattus norvegicus (#10116)
Mammalia (#40674)
7-Alpha-hydroxytestosterone in seminiferous tubules of rat testis.,
Arch Androl, 1983
Pubmed ID: 6573875

Other Databases

KEGG ID
HMDB ID
CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 22
Rings 4
Aromatic Rings 0
Rotatable Bonds 0
Van der Waals Molecular Volume 308.91
Topological Polar Surface Area 57.53
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
logP 3.42
Molar Refractivity 85.13

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Created at
-
Updated at
11th Mar 2021