SEGESTERONE ACETATE

Search structure
Synonyms:
Status: Approved (2018)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 9AMX4Q13CC

Structure
InChI Key CKFBRGLGTWAVLG-GOMYTPFNSA-N
Smile 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
Hydrogen Bond Donor 0.0
Number of Rotational Bond 2.0
Polar Surface Area 60.44
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 27.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Progesterone receptor agonist FDA PubMed

Related Entries

Scaffolds

Cross References

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