ESOMEPRAZOLE STRONTIUM

/static/temp/default.svg Search structure
Trade Names
Synonyms
Status
Molecule Category Salt-form
UNII C5N25H3803
Parent Compound: ESOMEPRAZOLE

Structure

InChI Key NCGHIAKEJNQSMS-QLGOZJDFSA-N
Smiles COc1ccc2[n-]c([S@@+]([O-])Cc3ncc(C)c(OC)c3C)nc2c1.COc1ccc2[n-]c([S@@+]([O-])Cc3ncc(C)c(OC)c3C)nc2c1.O.O.O.O.[Sr+2]
InChI
InChI=1S/2C17H18N3O3S.4H2O.Sr/c2*1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17;;;;;/h2*5-8H,9H2,1-4H3;4*1H2;/q2*-1;;;;;+2/t2*24-;;;;;/m00...../s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C34H44N6O10S2Sr
Molecular Weight 848.51
AlogP 2.9
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 77.1
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 24.0

Pharmacology

Mechanism of Action Action Reference
Potassium-transporting ATPase inhibitor INHIBITOR DailyMed

Target Conservation

Protein: Potassium-transporting ATPase
Description: Potassium-transporting ATPase alpha chain 1
Organism : Homo sapiens
P20648 ENSG00000105675
Protein: Potassium-transporting ATPase
Description: Potassium-transporting ATPase subunit beta
Organism : Homo sapiens
P51164 ENSG00000186009

Cross References

Resources Reference
ChEMBL CHEMBL2146140
FDA SRS C5N25H3803
PubChem 16048656
CONTENTS