Thiamin

• Formula: C₁₂H₁₇N₄OS⁺

• MW: 265.36

• SMILES String: Cc1c(CCO)sc[n+]1Cc1cnc(C)nc1N

• Synonyms: 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol; Aneurine; Thiadoxine; Thiamine; Vitamin B1

• CAS Reg. 59-43-8

• PubChem Substance Entry

• Common metabolism (KEGG)

• EAWAG-BBD reactions whose substrate is Thiamin
  • Thiamin -----> Formylaminopyrimidine + 5-Hydroxy-3-sulfanylpentan-2-one (reacID# r1461)

Page Author(s): Ah-Young Kang
November 08, 2013 Contact Us

This is the EAWAG-BBD compound, compID# c1257.
It was generated on June 16, 2025 at 12:22:23 AM CDT.

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