ISOPROTERENOL SULFATE

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Trade Names
Synonyms
Status
Molecule Category Salt-form
UNII 925FX3X776
Parent Compound: ISOPROTERENOL

Structure

InChI Key CUQPTVCVZLUXJB-UHFFFAOYSA-N
Smiles CC(C)NCC(O)c1ccc(O)c(O)c1.CC(C)NCC(O)c1ccc(O)c(O)c1.O.O.O=S(=O)(O)O
InChI
InChI=1S/2C11H17NO3.H2O4S.2H2O/c2*1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8;1-5(2,3)4;;/h2*3-5,7,11-15H,6H2,1-2H3;(H2,1,2,3,4);2*1H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C22H40N2O12S
Molecular Weight 556.63
AlogP 1.13
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 4.0
Polar Surface Area 72.72
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 15.0

Bioactivity

Mechanism of Action Action Reference
Adrenergic receptor beta agonist AGONIST FDA
Protein: Adrenergic receptor beta
Description: Beta-2 adrenergic receptor
Organism : Homo sapiens
P07550 ENSG00000169252
Protein: Adrenergic receptor beta
Description: Beta-1 adrenergic receptor
Organism : Homo sapiens
P08588 ENSG00000043591
Protein: Adrenergic receptor beta
Description: Beta-3 adrenergic receptor
Organism : Homo sapiens
P13945 ENSG00000188778

Cross References

Resources Reference
ChEMBL CHEMBL3989521
FDA SRS 925FX3X776
PubChem 656677
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