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Vitamin B1-[13C3]

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General Information
Catalog: BLP-007611
Molecular Formula: C9[13C]3H17ClN4OS
Molecular Weight: 303.79

Chemical Structure

Description	One of the isotopic labelled form of Thiamine which is an important vitamin, especially important for supporting energy levels and a healthy metabolism.
Synonyms	3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-(13C)methyl(4,5-13C2)-1,3-thiazol-3-ium chloride
IUPAC Name	2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-(1-13C)methyl-(4,5-13C2)1,3-thiazol-3-ium-5-yl]ethanol;chloride
Related CAS	59-43-8 (unlabelled)
Canonical SMILES	CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.[Cl-]
InChI	InChI=1S/C12H17N4OS.ClH/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);1H/q+1;/p-1/i1+1,8+1,11+1;
InChI Key	MYVIATVLJGTBFV-UGMVIRHGSA-M
Purity	>98%