Sapropterin dihydrochloride - 10mM in DMSO , Phenylalanine-4-hydroxylase activator, CAS No.69056-38-8, Phenylalanine-4-hydroxylase activator

CAS: 69056-38-8 Cat. No.: S425540 Molecular Weight: 314.17 EC Number: 663-669-3 PubChem CID: 135409471

GRADE & PURITY 10mM in DMSO

Synonyms

Sapropterin dihydrochloride|69056-38-8|Biopten|SAPROPTERIN HYDROCHLORIDE|Sapropterin HCl|Kuvan|(R)-2-Amino-6-((1R,2S)-1,2-dihydroxypropyl)-5,6,7,8-tetrahydropteridin-4(3H)-one dihydrochloride|Phenoptin|BioMarin T 1401|Shiratori SN 0588|Dapropterin hydroch

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Overview

Product description

Sapropterin ((6R)-BH4) dihydrochloride is an orally active phenylalanine hydroxylase (PAH) cofactor, which is effective in reducing blood phenylalanine concentrations. Sapropterin dihydrochloride can be used in study of phenylketonuria (PKU)

Product application

(6R)-BH4 has been used as a buffer component for assaying tyrosine hydroxylase enzyme activity in mouse brain tissues. (6R)-BH4 has also been identified as an activator compound from a LOPAC library screen using a fluorogenic α-glucosidase assay.

Specifications

Synonyms

Sapropterin dihydrochloride | 69056-38-8 | Biopten | SAPROPTERIN HYDROCHLORIDE | Sapropterin HCl | Kuvan | (R)-2-Amino-6-((1R, 2S)-1, 2-dihydroxypropyl)-5, 6, 7, 8-tetrahydropteridin-4(3H)-one dihydrochloride | Phenoptin | BioMarin T 1401 | Shiratori SN 0588 | Dapropterin hydroch

Specifications & Purity

10mM in DMSO

Biochemical and Physiological Mechanisms

Lack of tetrahydrobiopterin may cause hyperphenylalaninemia. Diseases like, Parkinson′s, autism, depression and Alzheimer′s shows low concentration of tetrahydrobiopterin in the cerebrospinal fluid. This coenzyme participates in dopamine (DA) synthesis.

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

This product requires cold chain shipping. Ground and other economy services are not available.

Action Type

ACTIVATOR

Mechanism of action

Phenylalanine-4-hydroxylase activator

Names and Identifiers

• Canonical Smiles: CC(C(C1CNC2=C(N1)C(=O)NC(=N2)N)O)O.Cl.Cl
• IUPAC Name: (6R)-2-amino-6-[(1R,2S)-1,2-dihydroxypropyl]-5,6,7,8-tetrahydro-3H-pteridin-4-one;dihydrochloride
• InChIKey: RKSUYBCOVNCALL-NTVURLEBSA-N
• INCHI: 1S/C9H15N5O3.2ClH/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7;;/h3-4,6,12,15-16H,2H2,1H3,(H4,10,11,13,14,17);2*1H/t3-,4+,6-;;/m0../s1
• Isomeric SMILES: C[C@@H]([C@@H]([C@H]1CNC2=C(N1)C(=O)NC(=N2)N)O)O.Cl.Cl
• PubChem CID: 135409471
• Molecular Weight: 314.17

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Pteridines and derivatives
• Subclass: Pterins and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Biopterins and derivatives
• Alternative Parents: Secondary alkylarylamines Pyrimidones Aminopyrimidines and derivatives Vinylogous amides Heteroaromatic compounds 1,3-aminoalcohols Secondary alcohols 1,2-diols 1,2-aminoalcohols Azacyclic compounds Primary amines Organopnictogen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Biopterin - Aminopyrimidine - Pyrimidone - Secondary aliphatic/aromatic amine - Pyrimidine - 1,3-aminoalcohol - Heteroaromatic compound - Vinylogous amide - 1,2-aminoalcohol - 1,2-diol - Secondary alcohol - Azacycle - Secondary amine - Organic nitrogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Alcohol - Organopnictogen compound - Hydrochloride - Organic oxygen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as biopterins and derivatives. These are coenzymes containing a 2-amino-pteridine-4-one derivative. They are mainly synthesized in several parts of the body, including the pineal gland.
• External Descriptors: hydrochloride

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(non-human)

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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

Mechanisms of Action

Chemical and Physical Properties

• Molecular Weight: 314.170 g/mol
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 313.071 Da
• Monoisotopic Mass: 313.071 Da
• Topological Polar Surface Area: 132.000 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 405.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 3
• 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: 3

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