Structure

InChI Key UBWXUGDQUBIEIZ-QNTYDACNSA-N
Smile C[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4CC[C@H]3[C@@H]1CC[C@@H]2OC(=O)CCc1ccccc1
InChI
InChI=1S/C27H34O3/c1-27-16-15-22-21-11-9-20(28)17-19(21)8-10-23(22)24(27)12-13-25(27)30-26(29)14-7-18-5-3-2-4-6-18/h2-6,17,21-25H,7-16H2,1H3/t21-,22+,23+,24-,25-,27-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C27H34O3
Molecular Weight 406.57
AlogP 5.67
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 4.0
Polar Surface Area 43.37
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 30.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Androgen Receptor agonist PubMed PubMed PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Parent

Adverse Reactions

System Organ Classification (SOC)
Relative Frequency (%)
Psychiatric disorders
40.0
Reproductive system and breast disorders
30.0
Endocrine disorders
10.0
Nervous system disorders
10.0
Skin and subcutaneous tissue disorders
10.0

Cross References

Resources Reference
CAS NUMBER 62-90-8
ChEBI 7468
ChEMBL CHEMBL1200412
DrugBank DB00984
DrugCentral 1882
EPA CompTox DTXSID2023353
FDA SRS KF7Z9K2T3W
Human Metabolome Database HMDB0015119
KEGG C08155
PubChem 229455
SureChEMBL SCHEMBL8443
ZINC ZINC000003881613