O-1812 - Moligand™ , Agonist of CB 1 receptor, CAS No.O612448, Agonist of CB 1 receptor

CAS: O612448 Cat. No.: O612448 PubChem CID: 9823107

GRADE & PURITY Moligand™

Synonyms

GTPL732 | (5Z,8Z,11Z,14Z)-20-cyano-N-[(2R)-1-hydroxypropan-2-yl]-16,16-dimethylicosa-5,8,11,14-tetraenamide | 5,8,11,14-Eicosatetraenamide, 20-cyano-N-((1R)-2-hydroxy-1-methylethyl)-16,16-dimethyl-, (5Z,8Z,11Z,14Z)- | UNII-5766D7AFA7 | (5Z,8Z,11Z,14Z)-20-

Storage

Room temperature

Specifications

Synonyms

GTPL732 | (5Z, 8Z, 11Z, 14Z)-20-cyano-N-[(2R)-1-hydroxypropan-2-yl]-16, 16-dimethylicosa-5, 8, 11, 14-tetraenamide | 5, 8, 11, 14-Eicosatetraenamide, 20-cyano-N-((1R)-2-hydroxy-1-methylethyl)-16, 16-dimethyl-, (5Z, 8Z, 11Z, 14Z)- | UNII-5766D7AFA7 | (5Z, 8Z, 11Z, 14Z)-20-

Specifications & Purity

Moligand™

Storage

Room temperature

Grade

Moligand™

Action Type

AGONIST

Mechanism of action

Agonist of CB 1 receptor

Names and Identifiers

• Canonical Smiles: OC[C@H](NC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\C(CCCCC#N)(C)C)C
• IUPAC Name: (5Z,8Z,11Z,14Z)-20-cyano-N-[(2R)-1-hydroxypropan-2-yl]-16,16-dimethylicosa-5,8,11,14-tetraenamide
• InChIKey: WZQHSBKOWZOASP-QLZKPENWSA-N
• INCHI: 1S/C26H42N2O2/c1-24(23-29)28-25(30)19-15-12-10-8-6-4-5-7-9-11-13-16-20-26(2,3)21-17-14-18-22-27/h4-5,8-11,16,20,24,29H,6-7,12-15,17-19,21,23H2,1-3H3,(H,28,30)/b5-4-,10-8-,11-9-,20-16-/t24-/m1/s1
• Isomeric SMILES: C[C@H](CO)NC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\C(C)(C)CCCCC#N
• PubChem CID: 9823107

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Class Fatty Acyls
      • Subclass Fatty amides

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Fatty Acyls
• Subclass: Fatty amides
• Intermediate Tree Nodes: Not available
• Direct Parent: N-acyl amines
• Alternative Parents: Secondary carboxylic acid amides Nitriles Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: N-acyl-amine - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Carbonitrile - Nitrile - Alcohol - Primary alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as n-acyl amines. These are compounds containing a fatty acid moiety linked to an amine group through an ester linkage.
• 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)

CNR1 Tclin Cannabinoid receptor 1 (1 Activities)

Discover Target: CNR1

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