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vitamin B1 (CAS NO : 59-43-8)

vitamin B1
vitamin B1

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Intersect 2
Rounded Top

Chemical Properties & Specifications

Identifiers of vitamin B1

Canonical Smiles
CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO.[Cl-]
Inchi Key
MYVIATVLJGTBFV-UHFFFAOYSA-M
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
CAS Number
59-43-8
Molecular Formula
C12H17N4OS.Cl
IUPAC
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;chloride

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