Products 86562-85-8

CAS 86562-85-8 is the registry number for S-ADENOSYL-L-METHIONINE P-TOLUENESULFONATE SALT. Offered by: Chemat Brand. Available pack sizes: on request.

Structural formula: {0} (CAS {1})

[(3S)-3-amino-3-carboxypropyl]-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium;4-methylbenzenesulfonate;tris(4-methylbenzenesulfonic acid) (CAS 86562-85-8) is a chemical compound with the molecular formula C43H54N6O17S5 and a molecular weight of 1087.3 g/mol. IUPAC name: [(3S)-3-amino-3-carboxypropyl]-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium;4-methylbenzenesulfonate;tris(4-methylbenzenesulfonic acid). InChIKey: FHDMRCBKJBDBDR-INKMGEERSA-N.

Identity
Molecular formulaC43H54N6O17S5
Molecular weight1087.3 g/mol
IUPAC name[(3S)-3-amino-3-carboxypropyl]-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium;4-methylbenzenesulfonate;tris(4-methylbenzenesulfonic acid)
InChIKeyFHDMRCBKJBDBDR-INKMGEERSA-N
SMILESCC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.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

Computed by PubChem (NCBI)