Name | 5-[3-Hydroxy-2-Methyl-5-(Phosphonooxymethyl)Pyridin-4-Yl]Pyrrolidine-2,4,4-Tricarboxylic Acid |
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Synonyms | 5-[3-Hydroxy-2-Methyl-5-(Phosphonooxymethyl)-4-Pyridyl]Pyrrolidine-2,4,4-Tricarboxylic Acid; 4-Carboxy-5-(Pyridyloxy-5'-Phosphate)Proline; Cppp |
Molecular Structure | ![]() |
Molecular Formula | C14H17N2O11P |
Molecular Weight | 420.27 |
CAS Registry Number | 126706-33-0 |
SMILES | C1=C(C(=C(C(=N1)C)O)C2NC(CC2(C(=O)O)C(=O)O)C(=O)O)CO[P](=O)(O)O |
InChI | 1S/C14H17N2O11P/c1-5-9(17)8(6(3-15-5)4-27-28(24,25)26)10-14(12(20)21,13(22)23)2-7(16-10)11(18)19/h3,7,10,16-17H,2,4H2,1H3,(H,18,19)(H,20,21)(H,22,23)(H2,24,25,26) |
InChIKey | FWQTWRXMADAWFI-UHFFFAOYSA-N |
Density | 1.797g/cm3 (Cal.) |
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Boiling point | 758.91°C at 760 mmHg (Cal.) |
Flash point | 412.774°C (Cal.) |
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