8,11,14-Eicosatrienoic Acid - ≥90% , CAS No.7324-41-6

CAS: 7324-41-6 Cat. No.: E304507 Peso molecular: 306.48

GRADE & PURITY ≥90%

Synonyms

8,11,14-Eicosatrienoic acid (VAN) | Dihomo-gamma-linolenic Acid (20:3, n-6) | cis-8?11?14-Eicosatrienoic Acid | AKOS027254925 | J-011373 | HOBAELRKJCKHQD-YHTMAJSVSA-N | SCHEMBL278573 | (8E,11E,14E)-8,11,14-Icosatrienoic acid # | (8E,11E,14E)-icosa-8,11,14

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifications

Sinónimos

8, 11, 14-Eicosatrienoic acid (VAN) | Dihomo-gamma-linolenic Acid (20:3, n-6) | cis-8?11?14-Eicosatrienoic Acid | AKOS027254925 | J-011373 | HOBAELRKJCKHQD-YHTMAJSVSA-N | SCHEMBL278573 | (8E, 11E, 14E)-8, 11, 14-Icosatrienoic acid # | (8E, 11E, 14E)-icosa-8, 11, 14

Especificaciones y pureza

≥90%

Condiciones de almacenamiento de almacenamiento

Room temperature, Desiccated

Enviado en

Normal

Pureza

≥90%

Nombres e identificadores

• Sonrisas canónicas: CCCCCC=CCC=CCC=CCCCCCCC(=O)O
• IUPAC Name: (8E,11E,14E)-icosa-8,11,14-trienoic acid
• InChIKey: HOBAELRKJCKHQD-YHTMAJSVSA-N
• INCHI: 1S/C20H34O2/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,2-5,8,11,14-19H2,1H3,(H,21,22)/b7-6+,10-9+,13-12+
• Isómeros SMILES: CCCCC/C=C/C/C=C/C/C=C/CCCCCCC(=O)O
• Peso molecular: 306.48
• Reaxy-Rn: 1796533
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1796533&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: 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: 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

• Peso molecular: 306.500 g/mol
• XLogP3: 7.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 15
• Exact Mass: 306.256 Da
• Monoisotopic Mass: 306.256 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 327.000
• 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