2-[3-[(4-Amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl dihydrogen phosphate; pyridine-3-carboxylate

CAS

17176-44-2

Catalog Number

ACM17176442

Category

Other Products

Molecular Weight

467.436 g/mol

Molecular Formula

C₁₈H₂₂N₅O₆PS

MSDS COA Spec Sheet

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Specification

Synonyms

AC1L1F6V, 17176-44-2, 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl dihydrogen phosphate; pyridine-3-carboxylate, 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-5-[2-(phosphonooxy)ethyl]-1,3-thiazol-3-ium pyridine-3-carboxylate

IUPAC Name

2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl dihydrogen phosphate;pyridine-3-carboxylate

Canonical SMILES

CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCOP(=O)(O)O.C1=CC(=CN=C1)C(=O)[O-]

InChI Key

RRGROXFLJUPTMK-UHFFFAOYSA-N

Exact Mass

467.10300

H-Bond Acceptor

H-Bond Donor