thiaminium

Thiamine 3-((4-Amino-2-methyl-5-pyrimidinyl)methyl)-5-(2- hydroxyethyl)-4-methylthiazolium chloride.

[(Science: chemical) 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2- hydroxyethyl)-4-methylthiazolium chloride. Chemical name: Thiazolium, 3-((4-amino-2-methyl-5-pyrimidinyl)methyl)-5-(2-hydroxyethyl)-4-methyl- chloride A B vitamin that prevents beriberi; maintains appetite and growth.More commonly known as vitamin C and found commonly in cereals, thiamine acts as a coenzyme used to breakdown sugars.

Molecular Formula: C₁₂H₁₇N₄OS⁺

InChI: InChI=1/C12H17N4OS/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15)/q+1/f/h13H2

InChIKey: InChIKey=JZRWCGZRTZMZEH-DLGLGFIGCW
SMILES: Cc1ncc(C[n+]2csc(CCO)c2C)c(N)n1

CAS number 59-43-8

Names:
    AIDS-012029
    AIDS012029
    Aneurin
    Antiberiberi factor
    Bequin
    NSC36226
    thiamine
    Thiamin
    Thiamine
    Thiamin
    thiamine
    Thiamine
    thiamine(1+) ion
    thiamine(1+)
    thiaminium
    vitamin B1
    Vitamin B1
    2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-5-yl]ethanol
    3[(4-Amino-2-methyl-5-pyrimidinyl)-methyl]-5-(2-hydroxyethyl)-4-methylthiazolium chloride
    59-43-8
    67-03-8

Registries:
    PubChem CID 1130
    Beilstein =3595616
    CAS 59-43-8 (from NIST)
    ChEBI 18385
    Gmelin 334462
    Kegg C00378
    PubChem ID 10584660
    PubChem ID 3668