Ademetionine disulfate tosylate

Base Information

• Chemical Name: Ademetionine disulfate tosylate
• CAS No.: 97540-22-2
• Deprecated CAS: 110899-33-7
• Molecular Formula: C15H22N6O5S^.2(H2SO4)^.C7H8SO3
• Molecular Weight: 766.79
• Hs Code.: 2934990002
• UNII: R96GHU97Q3,4G5PYL0DR1,564ROC9U09
• Wikidata: Q27261378,Q27259549,Q27287990
• NCI Thesaurus Code: C71745
• RXCUI: 2552301
• Mol file: 97540-22-2.mol

Synonyms:Ademetionine;AdoMet;FO 1561;FO-1561;FO1561;Gumbaral;S Adenosyl L Methionine;S Adenosylmethionine;S Adenosylmethionine Sulfate Tosylate;S Amet;S-Adenosyl-L-Methionine;S-Adenosylmethionine;S-Adenosylmethionine Sulfate Tosylate;SAM-e;Samyr

Chemical Property of Ademetionine disulfate tosylate

Chemical Property:

• Appearance/Colour: white powder
• PSA: 439.47000
• LogP: 1.20310
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• Solubility.: DMSO (Slightly, Heated), Water (Sparingly)
• Hydrogen Bond Donor Count: 9
• Hydrogen Bond Acceptor Count: 21
• Rotatable Bond Count: 7
• Exact Mass: 766.09141371
• Heavy Atom Count: 48
• Complexity: 815

Purity/Quality:

98% min ^*data from raw suppliers

S-Adenosyl-L-methionine Disulfate Tosylate ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C[S+](CCC(C(=O)[O-])N)CC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O.OS(=O)(=O)O.OS(=O)(=O)O
• Isomeric SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C[S+](CC[C@@H](C(=O)[O-])N)C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O.OS(=O)(=O)O.OS(=O)(=O)O
• Uses: Ademetionine Disulfate Tosylate is the disulfate-tosylate mixed salt of a mixture of diastereoisomers of the ademetionine ions. Ademetionine possesses anti-inflammatory activity and has been used in treatment of chronic liver disease. Ademetionine Disulfate Tosylate is used to study the survival time in various damage brain models.