ethynodiol diacetate

Ligand id: 7072

Name: ethynodiol diacetate

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 52.6
Molecular weight 384.23
XLogP 5
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
Approved drug? Yes
IUPAC Name
[(3S,8R,9S,10R,13S,14S,17R)-17-acetyloxy-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
International Nonproprietary Names
INN number INN
1336 etynodiol
Synonyms
Continuin®
Femulen®
SC-11800
Database Links
CAS Registry No. 297-76-7
ChEBI CHEBI:31580
ChEMBL Ligand CHEMBL1200624
DrugBank Ligand DB00823
PubChem CID 9270
Search Google for chemical match using the InChIKey ONKUMRGIYFNPJW-KIEAKMPYSA-N
Search Google for chemicals with the same backbone ONKUMRGIYFNPJW
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Wikipedia ethynodiol diacetate
Comments
This compound is a progestin.