Structure

InChI Key JKWKMORAXJQQSR-MOPIKTETSA-N
Smile CCCCCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C
InChI
InChI=1S/C28H44O3/c1-3-4-5-6-7-8-9-10-27(30)31-26-16-15-25-24-13-11-20-19-21(29)12-14-22(20)23(24)17-18-28(25,26)2/h19,22-26H,3-18H2,1-2H3/t22-,23+,24+,25-,26-,28-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C28H44O3
Molecular Weight 428.66
AlogP 7.18
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 9.0
Polar Surface Area 43.37
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 31.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Androgen Receptor agonist PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Hip Fractures 2 D006620 ClinicalTrials
Malnutrition 2 D044342 ClinicalTrials
HIV Wasting Syndrome 1 D019247 ClinicalTrials

Related Entries

Scaffolds

Adverse Reactions

System Organ Classification (SOC)
Relative Frequency (%)
Psychiatric disorders
12.03
Nervous system disorders
10.38
Musculoskeletal and connective tissue disorders
7.07
General disorders and administration site conditions
6.92
Skin and subcutaneous tissue disorders
6.77
Injury, poisoning and procedural complications
6.02
Renal and urinary disorders
5.86
Vascular disorders
5.71
Cardiac disorders
5.41
Endocrine disorders
4.81
Respiratory, thoracic and mediastinal disorders
4.66
Gastrointestinal disorders
3.61
Hepatobiliary disorders
3.16
Infections and infestations
2.71
Investigations
2.71
Metabolism and nutrition disorders
2.71
Reproductive system and breast disorders
2.71

Cross References

Resources Reference
CAS NUMBER 360-70-3
ChEBI 7467
ChEMBL CHEMBL1200946
DrugBank DB08804
DrugCentral 1881
EPA CompTox DTXSID7023352
FDA SRS H45187T098
Human Metabolome Database HMDB0015694
KEGG C08154
PubChem 9677
SureChEMBL SCHEMBL27975
ZINC ZINC000008214619