6，7-Dimethyl-5，6，7，8-tetrahydropterine hydrochloride - ≥95% , CAS No.945-43-7

CAS: 945-43-7 Cat. No.: D300994 Peso molecular: 231.68 Número EC: 213-413-8

GRADE & PURITY ≥95%

Synonyms

2-amino-6,7-dimethyl-3,4,5,6,7,8-hexahydropteridin-4-one hydrochloride | AS-73417 | DMPH4 | 2-amino-6,7-dimethyl-5,6,7,8-tetrahydropteridin-4(1H)-one hydrochloride | 2-amino-6,7-dimethyl-5,6,7,8-tetrahydro-3H-pteridin-4-one;hydrochloride | AKOS015902838 |

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Sinónimos

2-amino-6, 7-dimethyl-3, 4, 5, 6, 7, 8-hexahydropteridin-4-one hydrochloride | AS-73417 | DMPH4 | 2-amino-6, 7-dimethyl-5, 6, 7, 8-tetrahydropteridin-4(1H)-one hydrochloride | 2-amino-6, 7-dimethyl-5, 6, 7, 8-tetrahydro-3H-pteridin-4-one;hydrochloride | AKOS015902838 |

Especificaciones y pureza

≥95%

Mecanismos bioquímicos y fisiológicos

合成的还原蝶呤辅因子，用于一氧化氮合成酶，还用于苯丙氨酸、酪氨酸以及色氨酸羟化酶；活性低于天然辅因子四氢生物蝶呤 (BH4)。

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.

Pureza

≥95%

Nombres e identificadores

• Pubchem Sid: 504773313
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504773313
• Sonrisas canónicas: CC1C(NC2=C(N1)C(=O)NC(=N2)N)C.Cl
• IUPAC Name: 2-amino-6,7-dimethyl-5,6,7,8-tetrahydro-3H-pteridin-4-one;hydrochloride
• InChIKey: GIHYTRGUZVYCQX-UHFFFAOYSA-N
• INCHI: 1S/C8H13N5O.ClH/c1-3-4(2)11-6-5(10-3)7(14)13-8(9)12-6;/h3-4,10H,1-2H3,(H4,9,11,12,13,14);1H
• Isómeros SMILES: CC1C(NC2=C(N1)C(=O)NC(=N2)N)C.Cl
• WGK Alemania: 3
• Peso molecular: 231.68
• Reaxy-Rn: 4163890
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4163890&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pteridines and derivatives
      • Subclass Pterins and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pteridines and derivatives
• Subclass: Pterins and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pterins and derivatives
• Alternative Parents: Secondary alkylarylamines Pyrimidones Aminopyrimidines and derivatives Vinylogous amides Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Organooxygen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pterin - Aminopyrimidine - Pyrimidone - Secondary aliphatic/aromatic amine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Azacycle - Secondary amine - Amine - Hydrochloride - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as pterins and derivatives. These are polycyclic aromatic compounds containing a pterin moiety, which consist of a pteridine ring bearing a ketone and an amine group to form 2-aminopteridin-4(3H)-one.
• 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

Propiedades químicas y físicas

• Sensibilidad: light sensitive
• Peso molecular: 231.680 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 231.089 Da
• Monoisotopic Mass: 231.089 Da
• Topological Polar Surface Area: 91.500 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 346.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

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