4-Hydroxynicotinamide - CAS 7418-63-5
Catalog: |
BB061144 |
Product Name: |
4-Hydroxynicotinamide |
CAS: |
7418-63-5 |
Synonyms: |
4-Hydroxy-3-pyridinecarboxamide |
IUPAC Name: | 4-oxo-1H-pyridine-3-carboxamide |
Description: | 4-Hydroxynicotinamide is an intermediate in the synthesis of 1,4-Dihydro-1-methyl-4-oxo-3-pyridinecarboxamide-d3 (D453417), labelled analog of 1,4-Dihydro-1-methyl-4-oxo-3-pyridinecarboxamide (D453415); a compound that has been shown to be one of the potential novel biomarkers of peroxisome proliferation in the rat. |
Molecular Weight: | 138.13 |
Molecular Formula: | C6H6N2O2 |
Canonical SMILES: | C1=CNC=C(C1=O)C(=O)N |
InChI: | InChI=1S/C6H6N2O2/c7-6(10)4-3-8-2-1-5(4)9/h1-3H,(H2,7,10)(H,8,9) |
InChI Key: | UDTVJEZIOILIRG-UHFFFAOYSA-N |
References: | Ringeissen, S., Biomarkers, 8, 240 (2003); Shibata, K., et al. Biosci. Biotech. and Biochem., 77, 2105 (2013). |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
KR-20210110664-A | Quinoline compounds as inhibitors of TAM and MET kinases | 20190103 |
CA-3110502-A1 | Pyrazolo[3,4-b]pyridine compounds as inhibitors of tam and met kinases | 20180830 |
AU-2019331934-A1 | Multi-substituted pyridone derivatives and medical use thereof | 20180827 |
KR-20210066820-A | Multi-substituted pyridone derivatives and medical uses thereof | 20180827 |
WO-2020038460-A1 | Novel quinoline derivative inhibitor | 20180824 |
TW-202021589-A | A new quinoline derivative inhibitor | 20180824 |
TW-I726397-B | A new type of quinoline derivative inhibitor | 20180824 |
WO-2019074981-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | 20171009 |
EP-3694509-A1 | Heterocyclic compounds and uses thereof | 20171009 |
EP-3600312-A1 | Piperidinyl- and piperazinyl-substituted heteroaromatic carboxamides as modulators of gpr6 | 20170326 |
PMID | Publication Date | Title | Journal |
22200423 | 20120101 | Cellular toxicity of nicotinamide metabolites | Journal of renal nutrition : the official journal of the Council on Renal Nutrition of the National Kidney Foundation |
22069723 | 20110601 | 4-Pyridone-3-carboxamide-1-β-D-ribonucleoside triphosphate (4PyTP), a novel NAD metabolite accumulating in erythrocytes of uremic children: a biomarker for a toxic NAD analogue in other tissues? | Toxins |
20797575 | 20100901 | Distribution of purine nucleotides in uremic fluids and tissues | Journal of renal nutrition : the official journal of the Council on Renal Nutrition of the National Kidney Foundation |
18600548 | 20080601 | Metabolism of 4-pyridone-3-carboxamide-1-beta-D-ribonucleoside triphosphate and its nucleoside precursor in the erythrocytes | Nucleosides, nucleotides & nucleic acids |
18188525 | 20071201 | 4-pyridone-3-carboxamide ribonucleoside triphosphate accumulating in erythrocytes in end stage renal failure originates from tryptophan metabolism | Clinical and experimental medicine |
17065063 | 20060101 | The novel nucleotide 4KNTP, in high concentrations in erythrocytes of renal failure children: a comparison with accumulation of other putative precursors in the plasma | Nucleosides, nucleotides & nucleic acids |
Complexity: | 240 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 138.042927438 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 138.042927438 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 72.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.2 |
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