4-[[2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-thiazol-3-ium-5-yl]ethoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-4-hydroxy-butanoic acid

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SKU: JUWXHVVKSHTJQQ-UHFFFAOYSA-O

DESCRIPTION

Name: 4-[[2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-thiazol-3-ium-5-yl]ethoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-4-hydroxy-butanoic acid

Molecular Formula: C₁₆H₂₅N₄O₁₀P₂S+

SMILES: CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCOP(=O)(O)OP(=O)(O)OC(CCC(=O)O)O

InChI: InChI=1S/C16H24N4O10P2S/c1-10-13(33-9-20(10)8-12-7-18-11(2)19-16(12)17)5-6-28-31(24,25)30-32(26,27)29-15(23)4-3-14(21)22/h7,9,15,23H,3-6,8H2,1-2H3,(H4-,17,18,19,21,22,24,25,26,27)/p+1

InChI Key: JUWXHVVKSHTJQQ-UHFFFAOYSA-O

Molecular Weight: 527.4

Compound ID: 1113