5,6-dehydro Arachidonic Acid - ≥98%, A solution in ethanol , CAS No.58688-54-3

CAS: 58688-54-3 Cat. No.: D334618 Peso molecular: 302.45 PubChem CID: 6443815

GRADE & PURITY ≥98%, A solution in ethanol

Synonyms

Eicosa-cis-8,11,14-trien-5-ynoic acid | GIOQWSLKUVKKAO-QNEBEIHSSA-N | starbld0016500 | 8(Z),11(Z),14(Z)-eicosatrien-5-ynoic acid | CHEBI:189012 | 5,6-dehydro Arachidonic Acid | 5,6-dehydroarachidonic acid | SR-01000946980-1 | (8Z,11Z,14Z)-icosa-8,11,14-tr

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

5,6-dehydro Arachidonic Acid is an analog of arachidonic acid with an acetylene in the 5,6 position and an inhibitor of 5-LO (K|i|= 15 μM in rat basophilic leukemia cells, IC|50|= 10 μM In guinea pig leukocytes).

Specifications

Sinónimos

Eicosa-cis-8, 11, 14-trien-5-ynoic acid | GIOQWSLKUVKKAO-QNEBEIHSSA-N | starbld0016500 | 8(Z), 11(Z), 14(Z)-eicosatrien-5-ynoic acid | CHEBI:189012 | 5, 6-dehydro Arachidonic Acid | 5, 6-dehydroarachidonic acid | SR-01000946980-1 | (8Z, 11Z, 14Z)-icosa-8, 11, 14-tr

Especificaciones y pureza

≥98%, A solution in ethanol

Condiciones de almacenamiento de almacenamiento

Protected from light, 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.

Tipo de acción

INHIBITOR

Pureza

≥98%

Propiedades del producto

• Datos Ki: 5-LO: Ki= 15 μM (rat)

Nombres e identificadores

• Sonrisas canónicas: CCCCCC=CCC=CCC=CCC#CCCCC(=O)O
• IUPAC Name: (8Z,11Z,14Z)-icosa-8,11,14-trien-5-ynoic acid
• InChIKey: GIOQWSLKUVKKAO-QNEBEIHSSA-N
• INCHI: 1S/C20H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-
• Isómeros SMILES: CCCCC/C=C\C/C=C\C/C=C\CC#CCCCC(=O)O
• WGK Alemania: 2
• PubChem CID: 6443815
• Peso molecular: 302.45

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: Long-chain fatty acids
• Alternative Parents: Unsaturated fatty acids Straight chain fatty acids Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Long-chain fatty acid - Unsaturated fatty acid - Straight chain fatty acid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms.
• External Descriptors: Unsaturated fatty 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

Propiedades químicas y físicas

• Solubilidad: Soluble in water (100 μg/ml), DMSO (~100 mg/ml), DMF (~100 mg/ml), and ethanol.
• Sensibilidad: Light sensitive;Air sensitive
• Índice de refracción: n20D1.51 (Predicted)
• Punto de inflamación (°F): 62.6 °F
• Punto de inflamación (°C): 17 °C
• Punto de ebullición (°C): 78° C
• Peso molecular: 302.500 g/mol
• XLogP3: 6.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 12
• Exact Mass: 302.225 Da
• Monoisotopic Mass: 302.225 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 415.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 3
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 3
• Covalently-Bonded Unit Count: 1