Creatine monohydrate - 10mM in Water , CAS No.6020-87-7

CAS: 6020-87-7 Cat. No.: C425001 分子式: C₄H₉N₃O₂ · H₂O 分子量: 149.15 Beilstein Registry Number: 7942755 EC番号: 611-954-8

GRADE & PURITY 10mM in Water

Synonyms

Creatine, monohydrate | Glycine,N-(aminoiminomethyl)-N-(methyl-d3)-,monohydrate(9ci) | 3-chloro-1,1-diethoxy-propane | FT-0622269 | 2-[carbamimidoyl(methyl)amino]acetic acid;hydrate | CREATINE MONOHYDRATE [WHO-DD] | s6023 | Acetamide, N-benzyl-2-chloro- |

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

概要

Involved with rapid ATP production primarily in skeletal muscle tissue via the action of creatine kinase(s).

Specifications

同義語

Creatine, monohydrate | Glycine,N-(aminoiminomethyl)-N-(methyl-d3)-,monohydrate(9ci) | 3-chloro-1,1-diethoxy-propane | FT-0622269 | 2-[carbamimidoyl(methyl)amino]acetic acid;hydrate | CREATINE MONOHYDRATE [WHO-DD] | s6023 | Acetamide, N-benzyl-2-chloro- |

仕様と純度

10mM in Water

生化学的・生理学的メカニズム

Creatine is a nitrogenous compound that acts as a high-energy reservoir for the rapid regeneration of ATP. Approximately 95% of creatine is found in skeletal muscle, primarily as phosphocreatine. Creatine can be acquired through dietary consumption or for

保管条件

Store at -80°C

入荷

Dry ice packs + Cold packs

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

名前と識別子

パブケム・シド

528774938

カノニカル・スマイル

CN(CC(=O)O)C(=N)N.O

IUPAC Name

2-[carbamimidoyl(methyl)amino]acetic acid;hydrate

InChIKey

MEJYXFHCRXAUIL-UHFFFAOYSA-N

INCHI

1S/C4H9N3O2.H2O/c1-7(4(5)6)2-3(8)9;/h2H2,1H3,(H3,5,6)(H,8,9);1H2

異性体SMILES

CN(CC(=O)O)C(=N)N.O

WGKドイツ

1

RTECS

MB7706000

分子量

149.15

Beilstein

7942755

Reaxy-Rn

7942755

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7942755&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • 分類 Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 分類: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives
• Direct Parent: Alpha amino acids and derivatives
• Alternative Parents: Guanidines Monocarboxylic acids and derivatives Carboxylic acids Carboximidamides Organopnictogen compounds Organic oxides Imines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-amino acid or derivatives - Guanidine - Carboximidamide - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Imine - Carbonyl group - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
• 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

化学的性質と物理的性質

• 感度: Moisture sensitive.
• 融点（°C）: 292°C
• 分子量: 149.150 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 149.08 Da
• Monoisotopic Mass: 149.08 Da
• Topological Polar Surface Area: 91.400 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 134.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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