(-)-(R)-efonidipine - Moligand™ , Channel blocker of Ca v1.2;Channel blocker of Ca v3.1, CAS No.128194-13-8, Channel blocker of Ca v1.2;Channel blocker of Ca v3.1

CAS: 128194-13-8 Cat. No.: R611144 PubChem CID: 9830707

GRADE & PURITY Moligand™

Synonyms

(-)-efonidipine | UNII-BF2E1WS195 | R(-)-Efonidipine | BF2E1WS195 | (-)-(R)-efonidipine | EFONIDIPINE, (R)- | (R)-efonidipine | Efonidipine (R)-form [MI] | Q27078104 | 3-Pyridinecarboxylic acid, 5-(5,5-dimethyl-1,3,2-dioxaphosphorinan-2-yl)-1,4-dihydro-2,

Storage

Room temperature

Specifications

Sinónimos

(-)-efonidipine | UNII-BF2E1WS195 | R(-)-Efonidipine | BF2E1WS195 | (-)-(R)-efonidipine | EFONIDIPINE, (R)- | (R)-efonidipine | Efonidipine (R)-form [MI] | Q27078104 | 3-Pyridinecarboxylic acid, 5-(5, 5-dimethyl-1, 3, 2-dioxaphosphorinan-2-yl)-1, 4-dihydro-2,

Especificaciones y pureza

Moligand™

Condiciones de almacenamiento de almacenamiento

Room temperature

Grado

Moligand™

Tipo de acción

CHANNEL BLOCKER

Mecanismo de acción

Channel blocker of Ca v1.2;Channel blocker of Ca v3.1

Nombres e identificadores

• Sonrisas canónicas: CC1=C(C(=O)OCCN(c2ccccc2)Cc2ccccc2)[C@H](C(=C(N1)C)P1(=O)OCC(CO1)(C)C)c1cccc(c1)[N+](=O)[O-]
• IUPAC Name: 2-(phenyl-(phenylmethyl)amino)ethyl (4R)-5-(5,5-dimethyl-2-oxo-1,3-dioxa-2$l^{5}-phosphacyclohex-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate
• InChIKey: NSVFSAJIGAJDMR-WJOKGBTCSA-N
• INCHI: 1S/C34H38N3O7P/c1-24-30(33(38)42-19-18-36(28-15-9-6-10-16-28)21-26-12-7-5-8-13-26)31(27-14-11-17-29(20-27)37(39)40)32(25(2)35-24)45(41)43-22-34(3,4)23-44-45/h5-17,20,31,35H,18-19,21-23H2,1-4H3/t31-/m1/s1
• Isómeros SMILES: CC1=C([C@H](C(=C(N1)C)P2(=O)OCC(CO2)(C)C)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCN(CC4=CC=CC=C4)C5=CC=CC=C5
• PubChem CID: 9830707

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Phenylmethylamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Phenylmethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylbenzamines
• Alternative Parents: Dihydropyridinecarboxylic acids and derivatives Nitrobenzenes Aniline and substituted anilines Benzylamines Dialkylarylamines Nitroaromatic compounds Phosphonic acid diesters Aralkylamines Phosphonic acid esters Vinylogous amides Enoate esters Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Dialkylamines Organic oxoazanium compounds Enamines Monocarboxylic acids and derivatives Organic salts Organic zwitterions Carbonyl compounds Organic oxides Hydrocarbon derivatives Organophosphorus compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenylbenzamine - Dihydropyridinecarboxylic acid derivative - Nitrobenzene - Benzylamine - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Dihydropyridine - Phosphonic acid diester - Aralkylamine - Hydropyridine - Phosphonic acid ester - Vinylogous amide - Organophosphonic acid derivative - Alpha,beta-unsaturated carboxylic ester - Enoate ester - C-nitro compound - Organic nitro compound - Carboxylic acid ester - Amino acid or derivatives - Tertiary amine - Organoheterocyclic compound - Oxacycle - Secondary amine - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Secondary aliphatic amine - Organic 1,3-dipolar compound - Organic oxoazanium - Enamine - Azacycle - Monocarboxylic acid or derivatives - Organic salt - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organophosphorus compound - Carbonyl group - Organic nitrogen compound - Organic zwitterion - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
• 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

Objetivos asociados (humanos)

CACNA1G Tclin Voltage-dependent T-type calcium channel subunit alpha-1G (0 Activities)

Discover Target: CACNA1G

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

CACNA1C Tclin Voltage-dependent L-type calcium channel subunit alpha-1C (0 Activities)

Discover Target: CACNA1C

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