MSVIII-19 - Moligand™ , Antagonist of GluK1, CAS No.M612098, Antagonist of GluK1

CAS: M612098 Cat. No.: M612098 PubChem CID: 72199906

GRADE & PURITY Moligand™

Synonyms

8,9-dideoxyneodysiherbaine

Storage

Room temperature

Specifications

Synonyms

8, 9-dideoxyneodysiherbaine

Specifications & Purity

Moligand™

Storage

Room temperature

Grade

Moligand™

Action Type

ANTAGONIST

Mechanism of action

Antagonist of GluK1

Names and Identifiers

• Canonical Smiles: [O-]C(=O)[C@H](C[C@]1(O[C@H]2[C@@H](C1)OCCC2)C(=O)[O-])[NH3+]
• IUPAC Name: (2R,3aR,7aR)-2-[(2S)-2-azaniumyl-2-carboxylatoethyl]-hexahydro-2H-furo[3,2-b]pyran-2-carboxylate
• InChIKey: RZIYCCQNKHONBB-PRKAOEEVSA-M
• INCHI: 1S/C11H17NO6/c12-6(9(13)14)4-11(10(15)16)5-8-7(18-11)2-1-3-17-8/h6-8H,1-5,12H2,(H,13,14)(H,15,16)/p-1/t6-,7+,8+,11+/m0/s1
• Isomeric SMILES: C1C[C@@H]2[C@@H](C[C@](O2)(C[C@@H](C(=O)[O-])[NH3+])C(=O)[O-])OC1
• PubChem CID: 72199906

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Alpha amino acids
              • Level8 L-alpha-amino acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives - Alpha amino acids
• Direct Parent: L-alpha-amino acids
• Alternative Parents: Furopyrans Pyrans Oxanes Monosaccharides Dicarboxylic acids and derivatives Quaternary ammonium salts Oxolanes Furans Amino acids Carboxylic acid salts Oxacyclic compounds Carboxylic acids Dialkyl ethers Organic salts Hydrocarbon derivatives Monoalkylamines Organic oxides Carbonyl compounds Organic cations
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: L-alpha-amino acid - Furopyran - Dicarboxylic acid or derivatives - Monosaccharide - Oxane - Pyran - Furan - Oxolane - Quaternary ammonium salt - Carboxylic acid salt - Amino acid - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Organonitrogen compound - Organic nitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Amine - Organooxygen compound - Organic salt - Primary amine - Organic cation - Aliphatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as l-alpha-amino acids. These are alpha amino acids which have the L-configuration of the alpha-carbon atom.
• 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.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

GRIK1 Tclin Glutamate receptor ionotropic, kainate 1 (0 Activities)

Discover Target: GRIK1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)