(±)8-HETE - ≥98%, 100 ug/mL in ethanol , CAS No.79495-84-4

CAS: 79495-84-4 Cat. No.: H345925 Fórmula: C₂₀H₃₂O₃ Peso molecular: 320.5

GRADE & PURITY ≥98%, 100 ug/mL in ethanol

Synonyms

5,9,11,14-Eicosatetraenoicacid, 8-hydroxy-, (5Z,9E,11Z,14Z)- | CS-0105817 | NLUNAYAEIJYXRB-HEJOTXCHSA-N | 8-hydroxy-5(Z),9(E),11(Z),14(Z)-eicosatetraenoic acid | 8-hydroxyeicosatetraenoic acid, (E,Z,Z,Z)-isomer | (+/-)8-Hydroxy-5Z,9E,11Z,14Z-eicosatetraen

Storage

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

Shipped In

Ice chest + Ice pads

Visão geral

(±)8-HETE is one of the six monohydroxy fatty acids produced by the non-enzymatic oxidation of arachidonic acid, where the biological activity is likely to resemble that of its constituent enantiomers.

Specifications

Sinónimos

5,9,11,14-Eicosatetraenoicacid, 8-hydroxy-, (5Z,9E,11Z,14Z)- | CS-0105817 | NLUNAYAEIJYXRB-HEJOTXCHSA-N | 8-hydroxy-5(Z),9(E),11(Z),14(Z)-eicosatetraenoic acid | 8-hydroxyeicosatetraenoic acid, (E,Z,Z,Z)-isomer | (+/-)8-Hydroxy-5Z,9E,11Z,14Z-eicosatetraen

Especificações e pureza

≥98%, 100 ug/mL in ethanol

Condições de armazenamento de armazenamento

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

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥98%

Nomes e identificadores

• Pubchem Sid: 528753471
• Sorrisos canónicos: CCCCCC=CCC=CC=CC(CC=CCCCC(=O)O)O
• IUPAC Name: (5Z,9E,11Z,14Z)-8-hydroxyicosa-5,9,11,14-tetraenoic acid
• InChIKey: NLUNAYAEIJYXRB-HEJOTXCHSA-N
• INCHI: 1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-13-16-19(21)17-14-11-12-15-18-20(22)23/h6-7,9-11,13-14,16,19,21H,2-5,8,12,15,17-18H2,1H3,(H,22,23)/b7-6-,10-9-,14-11-,16-13+
• SMILES isoméricas: CCCCC/C=C\C/C=C\C=C\C(C/C=C\CCCC(=O)O)O
• CAS alternativo: 70968-93-3
• Peso molecular: 320.5
• Reaxy-Rn: 29201509
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=29201509&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Fatty Acyls
      • Subclass Eicosanoids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Fatty Acyls
• Subclass: Eicosanoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Hydroxyeicosatetraenoic acids
• Alternative Parents: Long-chain fatty acids Hydroxy fatty acids Unsaturated fatty acids Secondary alcohols Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydroxyeicosatetraenoic acid - Long-chain fatty acid - Hydroxy fatty acid - Fatty acid - Unsaturated fatty acid - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as hydroxyeicosatetraenoic acids. These are eicosanoic acids with an attached hydroxyl group and four CC double bonds.
• External Descriptors: Hydroxy/hydroperoxyeicosatetraenoic acids

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

Propriedades químicas e físicas

• Solubilidade: Soluble in water (0.8 mg/ml at 25.0° C), ethanol, DMSO, DMF, and PBS(pH7.2) (0.8 mg/ml).
• Sensibilidade: Light sensitive，Air sensitive
• Índice de refração: n20D1.51 (Predicted)
• Ponto de ebulição (°C): 78° C
• Peso molecular: 320.500 g/mol
• XLogP3: 5.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 14
• Exact Mass: 320.235 Da
• Monoisotopic Mass: 320.235 Da
• Topological Polar Surface Area: 57.500 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 392.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 4
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 4
• Covalently-Bonded Unit Count: 1