Structure

InChI Key HPFVBGJFAYZEBE-ZLQWOROUSA-N
Smiles C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1
InChI
InChI=1S/C27H40O3/c1-26-15-13-20(28)17-19(26)8-9-21-22-10-11-24(27(22,2)16-14-23(21)26)30-25(29)12-7-18-5-3-4-6-18/h17-18,21-24H,3-16H2,1-2H3/t21-,22-,23-,24-,26-,27-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C27H40O3
Molecular Weight 412.61
AlogP 6.4
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 0.0
Heavy Atoms 30.0

Bioactivity

Mechanism of Action Action Reference
Androgen Receptor agonist AGONIST DailyMed Wikipedia
Protein: Androgen Receptor

Description: Androgen receptor

Organism : Homo sapiens

P10275 ENSG00000169083

Cross References

Resources Reference
ChEBI 9463
ChEMBL CHEMBL1201101
DrugBank DB13943
DrugCentral 4454
FDA SRS M0XW1UBI14
KEGG C08156
PubChem 441404
SureChEMBL SCHEMBL40862
ZINC ZINC000004097468