KAPA (hydrochloride) - ≥98% , CAS No.177408-65-0

CAS: 177408-65-0 Cat. No.: K333556 Peso molecular: 223.68 Número EC: 888-286-0

GRADE & PURITY ≥98%

Synonyms

(8S)-8-Amino-7-oxononanoic acid--hydrogen chloride (1/1) | DTXSID00704278 | AKOS015924386 | SR-01000946788 | (S)-8-amino-7-oxononanoic acid hydrochloride | Nonanoic acid, 8-amino-7-oxo-, hydrochloride, (8S)- | 8-Amino-7-oxopelargonic acid hydrochloride |

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

Product Describtion:

KAPA (hydrochloride) is an intermediate in the biotin biosynthetic pathway.

Product Application:

An intermediate in the synthesis of biotin. Pimeloyl-CoA is transformed into AOP in the presence of L-alanine by the enzyme AOP synthase. The catalytic mechanism of AOP synthase has been studied for the elucidation of inhibitors as potential antimicrobial agents.

Specifications

Sinónimos

(8S)-8-Amino-7-oxononanoic acid--hydrogen chloride (1/1) | DTXSID00704278 | AKOS015924386 | SR-01000946788 | (S)-8-amino-7-oxononanoic acid hydrochloride | Nonanoic acid, 8-amino-7-oxo-, hydrochloride, (8S)- | 8-Amino-7-oxopelargonic acid hydrochloride |

Especificaciones y pureza

≥98%

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

≥98%

Nombres e identificadores

• Pubchem Sid: 504771270
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504771270
• Sonrisas canónicas: CC(C(=O)CCCCCC(=O)O)N.Cl
• IUPAC Name: (8S)-8-amino-7-oxononanoic acid;hydrochloride
• InChIKey: ZGPOLJARQCHVLY-FJXQXJEOSA-N
• INCHI: 1S/C9H17NO3.ClH/c1-7(10)8(11)5-3-2-4-6-9(12)13;/h7H,2-6,10H2,1H3,(H,12,13);1H/t7-;/m0./s1
• Isómeros SMILES: C[C@@H](C(=O)CCCCCC(=O)O)N.Cl
• Peso molecular: 223.68
• Reaxy-Rn: 7520895
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7520895&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Clase Fatty Acyls
      • Subclass Fatty acids and conjugates

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Fatty Acyls
• Subclass: Fatty acids and conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Medium-chain fatty acids
• Alternative Parents: Methyl-branched fatty acids Amino fatty acids Alpha-amino ketones Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Medium-chain fatty acid - Amino fatty acid - Branched fatty acid - Methyl-branched fatty acid - Alpha-aminoketone - Amino acid or derivatives - Amino acid - Ketone - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary aliphatic amine - Primary amine - Hydrochloride - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Amine - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.
• 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

• Solubilidad: Methanol (Slightly), Water (Slightly)
• Sensibilidad: Hygroscopic
• Punto de fusión (°C): 134-136° C
• Peso molecular: 223.700 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 223.098 Da
• Monoisotopic Mass: 223.098 Da
• Topological Polar Surface Area: 80.400 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 180.000
• 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

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