Ramosetron hydrochloride - ≥98%(HPLC) , Serotonin 3 (5-HT3) receptor antagonist, CAS No.132907-72-3, Serotonin 3 (5-HT3) receptor antagonist

CAS: 132907-72-3 Cat. No.: R166990 Peso molecular: 315.8 Número EC: 690-014-9 PubChem CID: 107999

GRADE & PURITY ≥98%(HPLC)

Synonyms

YM060 | YM 060 | YM-060 | AMY15420 | (R)-(-)-Ramosetron Hydrochloride | Tox21_112441_1 | (1-methylindol-3-yl)-[(5R)-4,5,6,7-tetrahydro-3H-benzimidazol-5-yl]methanone;hydrochloride. | (R)-5-((1-Methyl-3-indolyl)carbonyl)-4,5,6,7-tetrahydro-1H-benzimidazole

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Sinónimos

YM060 | YM 060 | YM-060 | AMY15420 | (R)-(-)-Ramosetron Hydrochloride | Tox21_112441_1 | (1-methylindol-3-yl)-[(5R)-4, 5, 6, 7-tetrahydro-3H-benzimidazol-5-yl]methanone;hydrochloride. | (R)-5-((1-Methyl-3-indolyl)carbonyl)-4, 5, 6, 7-tetrahydro-1H-benzimidazole

Especificaciones y pureza

≥98%(HPLC)

Mecanismos bioquímicos y fisiológicos

Ramosetron Hydrochloride(YM060 Hydrochloride) is a serotonin 5-HT3 receptor antagonist for the treatment of nausea and vomiting. Target: 5-HT3 Receptor Ramosetron hydrochloride selectively blocks serotonin receptors (5-HT3). Serotonin plays a vital role i

Condiciones de almacenamiento de almacenamiento

Store at -20°C

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Tipo de acción

ANTAGONIST

Mecanismo de acción

Serotonin 3 (5-HT3) receptor antagonist

Pureza

≥98%(HPLC)

Nombres e identificadores

• Sonrisas canónicas: CN1C=C(C2=CC=CC=C21)C(=O)C3CCC4=C(C3)NC=N4.Cl
• IUPAC Name: (1-methylindol-3-yl)-[(5R)-4,5,6,7-tetrahydro-3H-benzimidazol-5-yl]methanone;hydrochloride
• InChIKey: XIXYTCLDXQRHJO-RFVHGSKJSA-N
• INCHI: 1S/C17H17N3O.ClH/c1-20-9-13(12-4-2-3-5-16(12)20)17(21)11-6-7-14-15(8-11)19-10-18-14;/h2-5,9-11H,6-8H2,1H3,(H,18,19);1H/t11-;/m1./s1
• Isómeros SMILES: CN1C=C(C2=CC=CC=C21)C(=O)[C@@H]3CCC4=C(C3)NC=N4.Cl
• WGK Alemania: 3
• PubChem CID: 107999
• Peso molecular: 315.8

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Indoles and derivatives
      • Subclass N-alkylindoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Indoles and derivatives
• Subclass: N-alkylindoles
• Intermediate Tree Nodes: Not available
• Direct Parent: N-alkylindoles
• Alternative Parents: Indoles Aryl alkyl ketones N-methylpyrroles Benzenoids Vinylogous amides Imidazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: N-alkylindole - Indole - Aryl ketone - Aryl alkyl ketone - N-methylpyrrole - Substituted pyrrole - Benzenoid - Vinylogous amide - Imidazole - Azole - Pyrrole - Heteroaromatic compound - Ketone - Azacycle - Hydrochloride - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as n-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 1-position.
• 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 (no humanos)

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: H2O : 100 mg/mL (316.66 mM; Need ultrasonic)；DMSO : 32 mg/mL (101.33 mM; Need ultrasonic and warming)
• Sensibilidad: Moisture sensitive
• Rotación específica [α]: [α]/D -40 to -45°, c = 1 in methanol
• Peso molecular: 315.800 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 315.114 Da
• Monoisotopic Mass: 315.114 Da
• Topological Polar Surface Area: 50.700 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 413.000
• 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: 2

XLogP3