dihydrexidine - Moligand™ , Agonist of D 1 receptor, CAS No.137417-08-4, Agonist of D 1 receptor

CAS: 137417-08-4 Cat. No.: D609887 PubChem CID: 11403931

GRADE & PURITY Moligand™

Synonyms

(6aR,12bS)-5,6,6a,7,8,12b-hexahydrobenzo[a]phenanthridin-6-ium-10,11-diol;chloride

Storage

Room temperature

Specifications

Synonyms

(6aR, 12bS)-5, 6, 6a, 7, 8, 12b-hexahydrobenzo[a]phenanthridin-6-ium-10, 11-diol;chloride

Specifications & Purity

Moligand™

Storage

Room temperature

Grade

Moligand™

Action Type

AGONIST

Mechanism of action

Agonist of D 1 receptor

Names and Identifiers

• Canonical Smiles: C1CC2=CC(=C(C=C2C3C1[NH2+]CC4=CC=CC=C34)O)O.[Cl-]
• IUPAC Name: (6aR,12bS)-5,6,6a,7,8,12b-hexahydrobenzo[a]phenanthridin-6-ium-10,11-diol;chloride
• InChIKey: IJYUPBNUPIRQEP-SATBOSKTSA-N
• INCHI: 1S/C17H17NO2.ClH/c19-15-7-10-5-6-14-17(13(10)8-16(15)20)12-4-2-1-3-11(12)9-18-14;/h1-4,7-8,14,17-20H,5-6,9H2;1H/t14-,17-;/m1./s1
• Isomeric SMILES: C1CC2=CC(=C(C=C2[C@@H]3[C@@H]1[NH2+]CC4=CC=CC=C34)O)O.[Cl-]
• Alternate CAS: 137417-08-4
• PubChem CID: 11403931

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Quinolines and derivatives
      • Subclass Benzoquinolines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Quinolines and derivatives
• Subclass: Benzoquinolines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenanthridines and derivatives
• Alternative Parents: Tetralins Tetrahydroisoquinolines Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Quaternary ammonium salts Dialkylamines Azacyclic compounds Organooxygen compounds Organic zwitterions Organic chloride salts Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Phenanthridine - Tetrahydroisoquinoline - Tetralin - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aralkylamine - Benzenoid - Quaternary ammonium salt - Secondary aliphatic amine - Azacycle - Organic chloride salt - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Organic zwitterion - Organic salt - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as phenanthridines and derivatives. These are polycyclic compounds containing a phenanthridine moiety, which is a tricyclic system with two benzene rings joined by a pyridine forming a non-linear skeleton. Hydrogenated derivatives are also included.
• 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)

DRD1 Tclin D(1A) dopamine receptor (1 Activities)

Discover Target: DRD1

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