6-Fluoro-DL-tryptophan - Moligand™, ≥98% , Inhibitor of L-Tryptophan hydroxylase 1;Inhibitor of L-Tryptophan hydroxylase 2, CAS No.7730-20-3, Inhibitor of L-Tryptophan hydroxylase 1;Inhibitor of L-Tryptophan hydroxylase 2

CAS: 7730-20-3 Cat. No.: F343329 Peso molecular: 222.22 Beilstein Registry Number: 482552 Número EC: 231-788-6

GRADE & PURITY Moligand™, ≥98%

Synonyms

(+/-)-6-FLUOROTRYPTOPHAN | dl-6-Fluorotryptophan | F-6880 | YMEXGEAJNZRQEH-UHFFFAOYSA-N | CHEBI:182183 | NSC9364 | NSC-9364 | PS-6938 | CCG-235467 | SR-01000003311-1 | 2-amino-3-(6-luoro-1H-indol-3-yl)propanoic acid | Z1332305266 | 6-Fluorotryptophan, DL-

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Descripción general

6-Fluoro-DL-tryptophan (6-F-TRP) is a serotonin (5-HT) synthesis inhibitor, is metabolized in the brain and may be useful for tracing neuronal serotoninergic pools. 6-F-TRP is used as a competitive inhibitor of tryptophan binding to albumin and passage through the blood brain barrier.

Specifications

Sinónimos

(+/-)-6-FLUOROTRYPTOPHAN | dl-6-Fluorotryptophan | F-6880 | YMEXGEAJNZRQEH-UHFFFAOYSA-N | CHEBI:182183 | NSC9364 | NSC-9364 | PS-6938 | CCG-235467 | SR-01000003311-1 | 2-amino-3-(6-luoro-1H-indol-3-yl)propanoic acid | Z1332305266 | 6-Fluorotryptophan, DL-

Especificaciones y pureza

Moligand™, ≥98%

Condiciones de almacenamiento de almacenamiento

Protected from light, Store at -20°C, Argon charged

Enviado en

Ice chest + Ice pads

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

Grado

Moligand™

Tipo de acción

INHIBITOR

Mecanismo de acción

Inhibitor of L-Tryptophan hydroxylase 1;Inhibitor of L-Tryptophan hydroxylase 2

Pureza

≥98%

Propiedades del producto

• pKa: pKa: 2.22 (Predicted), pKa: 9.6 (Predicted)

Nombres e identificadores

• Sonrisas canónicas: C1=CC2=C(C=C1F)NC=C2CC(C(=O)O)N
• IUPAC Name: 2-amino-3-(6-fluoro-1H-indol-3-yl)propanoic acid
• InChIKey: YMEXGEAJNZRQEH-UHFFFAOYSA-N
• INCHI: 1S/C11H11FN2O2/c12-7-1-2-8-6(3-9(13)11(15)16)5-14-10(8)4-7/h1-2,4-5,9,14H,3,13H2,(H,15,16)
• Isómeros SMILES: C1=CC2=C(C=C1F)NC=C2CC(C(=O)O)N
• WGK Alemania: 3
• RTECS: YN6850000
• Peso molecular: 222.22
• Beilstein: 482552
• Reaxy-Rn: 6483115
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6483115&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Indoles and derivatives
      • Subclass Indolyl carboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Indoles and derivatives
• Subclass: Indolyl carboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Indolyl carboxylic acids and derivatives
• Alternative Parents: 3-alkylindoles Alpha amino acids Aralkylamines Substituted pyrroles Aryl fluorides Benzenoids Heteroaromatic compounds Amino acids Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Organofluorides Monoalkylamines Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Indolyl carboxylic acid derivative - Alpha-amino acid - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Aralkylamine - Aryl fluoride - Aryl halide - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organopnictogen compound - Primary aliphatic amine - Primary amine - Amine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as indolyl carboxylic acids and derivatives. These are compounds containing a carboxylic acid chain (of at least 2 carbon atoms) linked to an indole ring.
• 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)

TPH1 Tclin Tryptophan 5-hydroxylase 1 (0 Activities)

Discover Target: TPH1

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

TPH2 Tchem Tryptophan 5-hydroxylase 2 (0 Activities)

Discover Target: TPH2

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

Objetivos asociados (no humanos)

Amphibalanus improvisus (34 Activities)

Explore this target

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

ftmPT1 Brevianamide F prenyltransferase (40 Activities)

Discover Target: ftmPT1

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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in water (partly), and 0.5 M hydrochloric acid (50 mg/ml).
• Sensibilidad: Moisture sensitive；Air sensitive；Light sensitive
• Índice de refracción: n20D1.67 (Predicted)
• Rotación específica [α]: α25/D 0°, c = 1 in 1M hydrochloric acid
• Punto de ebullición (°C): ~450.7° C at 760 mmHg (Predicted)
• Punto de fusión (°C): 280-285° C (lit.)(dec.)
• Peso molecular: 222.220 g/mol
• XLogP3: -0.800
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 222.08 Da
• Monoisotopic Mass: 222.08 Da
• Topological Polar Surface Area: 79.100 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 275.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1