Carnosine HydrochlorideProduct ingredient for Carnosine
- Name
- Carnosine Hydrochloride
- Drug Entry
- Carnosine
Carnosine has been investigated for the treatment of Gulf War Illness.
- Accession Number
- DBSALT002049
- Structure
Structure for Carnosine Hydrochloride (DBSALT002049)
- Synonyms
- Not Available
- UNII
- 5II09M0I3L
- CAS Number
- 5852-99-3
- Weight
- Average: 262.69
Monoisotopic: 262.0832681 - Chemical Formula
- C9H15ClN4O3
- InChI Key
- HIXYEIRACBUSON-FJXQXJEOSA-N
- InChI
- InChI=1S/C9H14N4O3.ClH/c10-2-1-8(14)13-7(9(15)16)3-6-4-11-5-12-6;/h4-5,7H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16);1H/t7-;/m0./s1
- IUPAC Name
- (2S)-2-(3-aminopropanamido)-3-(1H-imidazol-5-yl)propanoic acid hydrochloride
- SMILES
- Cl.NCCC(=O)N[C@@H](CC1=CN=CN1)C(O)=O
- External Links
- ChemSpider
- 32697847
- Predicted Properties
Property Value Source Water Solubility 11.1 mg/mL ALOGPS logP -3 ALOGPS logP -4.5 Chemaxon logS -1.3 ALOGPS pKa (Strongest Acidic) 3.37 Chemaxon pKa (Strongest Basic) 9.13 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 4 Chemaxon Polar Surface Area 121.1 Å2 Chemaxon Rotatable Bond Count 6 Chemaxon Refractivity 55.56 m3·mol-1 Chemaxon Polarizability 22.37 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon