SEGESTERONE ACETATE

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Synonyms
Status
Molecule Category Free-form
UNII 9AMX4Q13CC

Structure

InChI Key CKFBRGLGTWAVLG-GOMYTPFNSA-N
Smiles C=C1C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]2(C)[C@@]1(OC(C)=O)C(C)=O
InChI
InChI=1S/C23H30O4/c1-13-11-21-20-7-5-16-12-17(26)6-8-18(16)19(20)9-10-22(21,4)23(13,14(2)24)27-15(3)25/h12,18-21H,1,5-11H2,2-4H3/t18-,19+,20+,21-,22-,23-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C23H30O4
Molecular Weight 370.49
AlogP 4.19
Hydrogen Bond Acceptor 4.0
Number of Rotational Bond 2.0
Polar Surface Area 60.44
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 27.0

Pharmacology

Mechanism of Action Action Reference
Progesterone receptor agonist AGONIST FDA PubMed

Target Conservation

Protein: Progesterone receptor
Description: Progesterone receptor
Organism : Homo sapiens
P06401 ENSG00000082175

Cross References

Resources Reference
ChEBI 135563
ChEMBL CHEMBL3707377
DrugBank DB14583
DrugCentral 3175
FDA SRS 9AMX4Q13CC
SureChEMBL SCHEMBL1261001
ZINC ZINC000005167230
CONTENTS