L-Asparagine - Moligand™, ≥98% , CAS No.70-47-3

CAS: 70-47-3 Cat. No.: A105949 Fórmula: C₄H₈N₂O₃ Peso molecular: 132.12 Beilstein Registry Number: 1723527 Número EC: 200-735-9

GRADE & PURITY Moligand™, ≥98%

Synonyms

H-Asn-OH | aspartic acid beta-amide | EINECS 200-735-9 | L-asparagine | MFCD00064401 | Aspartamic acid | Aspartic acid b-amide | L-2-aminosuccinamic acid | Aspartic acid .beta. amide | HSDB 7425 | US9144538, L-Asparigine | Aspartic acid beta amide | L-Asn

Storage

Room temperature,Argon charged,Desiccated

Shipped In

Normal

Descripción general

Product Application:

Identification and quantification of free amino acids released by hydroxyl radical oxidation of proteins and peptides; To study the promoting effect of amino acids on food consumption of Drosophila melanogaster. Non-enzymatic gluconeogenesis was studied.

Specifications

Sinónimos

H-Asn-OH | aspartic acid beta-amide | EINECS 200-735-9 | L-asparagine | MFCD00064401 | Aspartamic acid | Aspartic acid b-amide | L-2-aminosuccinamic acid | Aspartic acid .beta. amide | HSDB 7425 | US9144538, L-Asparigine | Aspartic acid beta amide | L-Asn

Especificaciones y pureza

Moligand™, ≥98%

Mecanismos bioquímicos y fisiológicos

L-asparagine is an uncharged derivative of aspartate. It has a polar side chain and is a non-essential amino acid

Condiciones de almacenamiento de almacenamiento

Room temperature,Argon charged,Desiccated

Enviado en

Normal

Grado

Moligand™

Pureza

≥98%

Nombres e identificadores

Pubchem Sid

488180033

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180033

Sonrisas canónicas

C(C(C(=O)O)N)C(=O)N

IUPAC Name

(2S)-2,4-diamino-4-oxobutanoic acid

InChIKey

DCXYFEDJOCDNAF-REOHCLBHSA-N

INCHI

1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1

Isómeros SMILES

C([C@@H](C(=O)O)N)C(=O)N

WGK Alemania

1

Peso molecular

132.12

Beilstein

1723527

Reaxy-Rn

1723525

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1723525&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Asparagine and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Asparagine and derivatives
• Alternative Parents: L-alpha-amino acids Fatty amides Fatty acids and conjugates Primary carboxylic acid amides Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Asparagine or derivatives - Alpha-amino acid - L-alpha-amino acid - Fatty amide - Fatty acyl - Fatty acid - Carboxamide group - Amino acid - Primary carboxylic acid amide - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Primary aliphatic amine - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Amine - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as asparagine and derivatives. These are compounds containing asparagine or a derivative thereof resulting from reaction of asparagine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• External Descriptors: Common amino acids

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.

DOI: 10.1186/s13321-016-0174-y

Objetivos asociados (humanos)

F2 Tclin Thrombin (11687 Activities)

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CA2 Tclin Carbonic anhydrase II (17698 Activities)

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ESR1 Tclin Estrogen receptor alpha (17718 Activities)

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PGR Tclin Progesterone receptor (8562 Activities)

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CHRM2 Tclin Muscarinic acetylcholine receptor M2 (10671 Activities)

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HTR1A Tclin Serotonin 1a (5-HT1a) receptor (14969 Activities)

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ADRA2A Tclin Alpha-2a adrenergic receptor (9450 Activities)

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AR Tclin Androgen Receptor (11781 Activities)

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CHRM1 Tclin Muscarinic acetylcholine receptor M1 (12690 Activities)

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GABRA1 Tclin GABA receptor alpha-1 subunit (399 Activities)

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MAOA Tclin Monoamine oxidase A (11911 Activities)

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DRD1 Tclin Dopamine D1 receptor (9720 Activities)

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ACHE Tclin Acetylcholinesterase (18204 Activities)

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PTGS1 Tclin Cyclooxygenase-1 (9233 Activities)

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SLC6A2 Tclin Norepinephrine transporter (10102 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLC6A4 Tclin Serotonin transporter (12625 Activities)

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ADRA1A Tclin Alpha-1a adrenergic receptor (8359 Activities)

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OPRM1 Tclin Mu opioid receptor (19785 Activities)

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DRD3 Tclin Dopamine D3 receptor (14368 Activities)

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SLC6A3 Tclin Dopamine transporter (10535 Activities)

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PDE3A Tclin Phosphodiesterase 3A (3309 Activities)

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HTR2B Tclin Serotonin 2b (5-HT2b) receptor (10323 Activities)

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TBXA2R Tclin Thromboxane A2 receptor (5717 Activities)

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PDE4A Tclin Phosphodiesterase 4A (1943 Activities)

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ADORA3 Tchem Adenosine A3 receptor (15931 Activities)

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CA1 Tclin Carbonic anhydrase I (13240 Activities)

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HRH3 Tclin Histamine H3 receptor (10389 Activities)

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KDR Tclin Vascular endothelial growth factor receptor 2 (20924 Activities)

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SLC1A4 Tbio Neutral amino acid transporter A (18 Activities)

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CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)

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SLC1A5 Tchem Neutral amino acid transporter B(0) (65 Activities)

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Objetivos asociados (no humanos)

Hdac6 Histone deacetylase 6 (222 Activities)

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H4 (48 Activities)

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rep Replicase polyprotein 1ab (378 Activities)

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Grin1 Glutamate NMDA receptor (6467 Activities)

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Slc16a10 Monocarboxylate transporter 10 (73 Activities)

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Slc1a5 Amino acid transporter (271 Activities)

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Slc7a10 Asc-type amino acid transporter 1 (14 Activities)

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Carbonic anhydrase-like protein, putative (25 Activities)

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Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in water, very slightly soluble in ether, methanol, ethanol, benzene
• Sensibilidad: Hygroscopic
• Rotación específica [α]: 29° (C=5,HCl(1+1))
• Punto de fusión (°C): 234-235°C
• Peso molecular: 132.120 g/mol
• XLogP3: -3.400
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 132.053 Da
• Monoisotopic Mass: 132.053 Da
• Topological Polar Surface Area: 106.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 134.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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