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Home > Encyclopedia > 5-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]pyrrolidine-2,4-dicarboxylic acid

5-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]pyrrolidine-2,4-dicarboxylic acid

5-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]pyrrolidine-2,4-dicarboxylic acid structure

5-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]pyrrolidine-2,4-dicarboxylic acid 

structure
  • CAS No:

    126706-34-1

  • Formula:

    C13H17N2O9P

  • Chemical Name:

    5-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]pyrrolidine-2,4-dicarboxylic acid

5-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]pyrrolidine-2,4-dicarboxylic acid Basic Attributes

376.25600

376.06716712

Characteristics

196.32000

0.22210

1.685g/cm3

704.1ºC

379.6ºC

1.634

8.27E-21mmHg at 25°C

Drug Information

4,4-dicarboxy-5-(pyridoxyl-5'-phosphate)proline

Computed Properties

Molecular Weight:376.26
XLogP3:-4.7
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:6
Exact Mass:376.06716712
Monoisotopic Mass:376.06716712
Topological Polar Surface Area:187
Heavy Atom Count:25
Complexity:568
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 5-[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]pyrrolidine-2,4-dicarboxylic acid

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