Lysine acetylsalicylateProduct ingredient for Acetylsalicylic acid

Name
Lysine acetylsalicylate
Drug Entry
Acetylsalicylic acid

Also known as Aspirin, acetylsalicylic acid (ASA) is a commonly used drug for the treatment of pain and fever due to various causes. Acetylsalicylic acid has both anti-inflammatory and antipyretic effects. This drug also inhibits platelet aggregation and is used in the prevention of blood clots stroke, and myocardial infarction (MI) Label.

Interestingly, the results of various studies have demonstrated that long-term use of acetylsalicylic acid may decrease the risk of various cancers, including colorectal, esophageal, breast, lung, prostate, liver and skin cancer 15. Aspirin is classified as a non-selective cyclooxygenase (COX) inhibitor 11,14 and is available in many doses and forms, including chewable tablets, suppositories, extended release formulations, and others 19.

Acetylsalicylic acid is a very common cause of accidental poisoning in young children. It should be kept out of reach from young children, toddlers, and infants Label.

Accession Number
DBSALT003034
Structure
Thumb
Synonyms
Acetyl salicylate lysine / Acetylsalicylate lysine / Acetylsalicylic acid lysine salt / Aspirin DL-lysine / DL-Lysine acetylsalicylate / DL-Lysine acetylsalicylic acid salt
UNII
2JJ274J145
CAS Number
62952-06-1
Weight
Average: 326.349
Monoisotopic: 326.147786436
Chemical Formula
C15H22N2O6
InChI Key
JJBCTCGUOQYZHK-UHFFFAOYSA-N
InChI
InChI=1S/C9H8O4.C6H14N2O2/c1-6(10)13-8-5-3-2-4-7(8)9(11)12;7-4-2-1-3-5(8)6(9)10/h2-5H,1H3,(H,11,12);5H,1-4,7-8H2,(H,9,10)
IUPAC Name
5-amino-5-carboxypentan-1-aminium 2-(acetyloxy)benzoate
SMILES
NC(CCCC[NH3+])C(O)=O.CC(=O)OC1=CC=CC=C1C([O-])=O
ChemSpider
40238
ChEMBL
CHEMBL1697753
Predicted Properties
PropertyValueSource
Water Solubility0.153 mg/mLALOGPS
logP-0.8ALOGPS
logP1.24ChemAxon
logS-3.3ALOGPS
pKa (Strongest Acidic)3.41ChemAxon
pKa (Strongest Basic)-7.1ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count3ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area66.43 Å2ChemAxon
Rotatable Bond Count8ChemAxon
Refractivity55.28 m3·mol-1ChemAxon
Polarizability16.52 Å3ChemAxon
Number of Rings1ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon