Structure Database (LMSD)
Common Name
Bolasterone
Systematic Name
17β-hydroxy-7α,17-dimethylandrost-4-en-3-one
Synonyms
LM ID
LMST02020017
Status
Active
Exact Mass
Calculate m/z
316.24023
Formula
Abbrev
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
IVFYLRMMHVYGJH-VLOLGRDOSA-N
InChi (Click to copy)
InChI=1S/C21H32O2/c1-13-11-14-12-15(22)5-8-19(14,2)16-6-9-20(3)17(18(13)16)7-10-21(20,4)23/h12-13,16-18,23H,5-11H2,1-4H3/t13-,16+,17+,18-,19+,20+,21+/m1/s1
SMILES (Click to copy)
C1[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@](C)(O)CC[C@@]4([H])[C@]3([H])[C@H](C)CC2=CC(=O)C1
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
synthetic construct
(#32630)
CLINICAL EVALUATION OF A NEW ANABOLIC AGENT 7-ALPHA,17-ALPHA-DIMETHYLTESTOSTERONE (BOLASTERONE).,
Clin Pharmacol Ther, 1963
Clin Pharmacol Ther, 1963
Pubmed ID:
14079251
Other Databases
Wikipedia
KEGG ID
HMDB ID
CHEBI ID
LIPIDBANK ID
SST0147
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
23
Rings
4
Aromatic Rings
0
Rotatable Bonds
0
Van der Waals Molecular Volume
334.72
Topological Polar Surface Area
37.30
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
logP
4.80
Molar Refractivity
92.39
Admin
Created at
-
Updated at
11th Mar 2021