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· · COA & SDS disponible pour chaque produit · Expédition le jour même sur les articles en stock Chelidamic acid hydrate - ≥95% , CAS No.138-60-3
Synonyms
2, 1,4-dihydro-4-oxo- | DS-1684 | UNII-1A59BH8SXE | 2,6-Pyridinedicarboxylic acid, 4-hydroxy- | Chelidamic acid hydrate | DTXSID00160451 | NCGC00015270-03 | 4-oxo-1,4-dihydropyridine-2,6-dicarboxylic acid | BBL028110 | 1,4-Dihydro-4-oxopyridine-2,6-dicarb
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Why this grade ≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Vue d’ensemble glutamate analogs as an inhibitor of glutamate decarboxylase.
Specifications Synonymes
2, 1,4-dihydro-4-oxo- | DS-1684 | UNII-1A59BH8SXE | 2,6-Pyridinedicarboxylic acid, 4-hydroxy- | Chelidamic acid hydrate | DTXSID00160451 | NCGC00015270-03 | 4-oxo-1,4-dihydropyridine-2,6-dicarboxylic acid | BBL028110 | 1,4-Dihydro-4-oxopyridine-2,6-dicarb
Spécifications et pureté
≥95%
Mécanismes biochimiques et physiologiques
Among the most potent of the tested "conformationally restricted glutamate analogs" as an inhibitor of glutamate decarboxylase
Conditions de stockage de stockage
Room temperature
Noms et identifiants Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488180874
Sourires canoniques
C1=C(NC(=CC1=O)C(=O)O)C(=O)O
IUPAC Name
4-oxo-1H-pyridine-2,6-dicarboxylic acid
InChIKey
XTLJJHGQACAZMS-UHFFFAOYSA-N
INCHI
1S/C7H5NO5/c9-3-1-4(6(10)11)8-5(2-3)7(12)13/h1-2H,(H,8,9)(H,10,11)(H,12,13)
Isomères SMILES
C1=C(NC(=CC1=O)C(=O)O)C(=O)O
CAS alternatif
199926-39-1
Poids moléculaire
183.12 (anhydrous basis）
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=476229&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds Classe Pyridines and derivatives Subclass Pyridinecarboxylic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Pyridinecarboxylic acids Alternative Parents Dihydropyridinecarboxylic acids and derivatives Dicarboxylic acids and derivatives Vinylogous amides Heteroaromatic compounds Cyclic ketones Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Dihydropyridinecarboxylic acid derivative - Pyridine carboxylic acid - Dihydropyridine - Dicarboxylic acid or derivatives - Hydropyridine - Heteroaromatic compound - Vinylogous amide - Cyclic ketone - Carboxylic acid - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid group. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Structure 3D Cibles associées (humaines) Cibles associées (non humaines) Mécanismes d'action Certificats (CoA, COO, BSE/TSE et tableau d'analyse) Propriétés chimiques et physiques Point de fusion (°C) 267 °C Poids moléculaire 183.120 g/mol XLogP3 -0.400 Hydrogen Bond Donor Count 3 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 2 Exact Mass 183.017 Da Monoisotopic Mass 183.017 Da Topological Polar Surface Area 104.000 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 320.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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