Products 22457-89-2

CAS 22457-89-2 appears in our catalog under these names: S-(2-(N-((4-Amino-2-methylpyrimidin-5-yl)methyl)formamido)-5-(phosphonooxy)pent-2-en-3-yl)benzothioa, 97%, Benfotiamine, Benfotiamine, >95% (HPLC), Benfotiamine/ 99.91% (existing batch purity), Benfotiamine, >98.0%(HPLC)(T). Offered by: Fluorochem, Chemat Brand, TRC, TargetMol, GLPBio. Available pack sizes: 250mg, 1g, 5g, 25g, 100g, on request, 100mg, 200mg.

Benfotiamine is a thioester that is a synthetic analogue of thiamine obtained by acylative cleavage of the thiazole ring and O-phospohorylation. It has a role as an antioxidant, a protective agent, a nutraceutical, an immunological adjuvant and a provitamin B1. It is a member of formamides, an organic phosphate, an aminopyrimidine and a thioester. It is functionally related to a thiamine(1+).

Source: ChEBI

Identity
Molecular formulaC19H23N4O6PS
Molecular weight466.4 g/mol
IUPAC nameS-[(Z)-2-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-5-phosphonooxypent-2-en-3-yl] benzenecarbothioate
InChIKeyBTNNPSLJPBRMLZ-LGMDPLHJSA-N
SMILESCC1=NC=C(C(=N1)N)CN(C=O)/C(=C(/CCOP(=O)(O)O)\SC(=O)C2=CC=CC=C2)/C

Computed by PubChem (NCBI)