Octacosanoic acid - ≥98% , CAS No.506-48-9

CAS: 506-48-9 Cat. No.: O299013 Peso molecular: 424.74 Número EC: 208-041-8

GRADE & PURITY ≥98%

Synonyms

Octacosansaeure | 1-octacosanoic acid | octacosoic acid | Octacosancarbonsaeure | n-octacosanoate | octacosanoicacid | Montanic acid | n-octacosanoic acid | octaeicosanoic acid | octacosoate

Storage

Store at 2-8°C

Shipped In

Wet ice

Descripción general

Octacosanoic acid is a very long-chain saturated fatty acid. It is the major component of D-003, a mixture of very long-chain aliphatic acids purified from sugar cane wax that has antiplatelet and cholesterol-lowering activities in animal models.

Specifications

Sinónimos

Octacosansaeure | 1-octacosanoic acid | octacosoic acid | Octacosancarbonsaeure | n-octacosanoate | octacosanoicacid | Montanic acid | n-octacosanoic acid | octaeicosanoic acid | octacosoate

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O
• IUPAC Name: octacosanoic acid
• InChIKey: UTOPWMOLSKOLTQ-UHFFFAOYSA-N
• INCHI: 1S/C28H56O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28(29)30/h2-27H2,1H3,(H,29,30)
• Isómeros SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O
• Peso molecular: 424.74
• Reaxy-Rn: 1801616
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1801616&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: Very long-chain fatty acids
• Alternative Parents: Straight chain fatty acids Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Very long-chain 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 very long-chain fatty acids. These are fatty acids with an aliphatic tail that contains at least 22 carbon atoms.
• External Descriptors: Straight chain 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

Objetivos asociados (no humanos)

Streptococcus mutans (2687 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Punto de fusión (°C): 91-93℃
• Peso molecular: 424.700 g/mol
• XLogP3: 12.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 26
• Exact Mass: 424.428 Da
• Monoisotopic Mass: 424.428 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 30
• Formal Charge: 0
• Complexity: 327.000
• 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: 1

Referencias

1. He Jinhua, Wang Chenhui, Liu Mingrui, Ramzan Muhammad, Long Zhiwei, Wu Xian-gang, Chen Yu, Zhong Haizheng.  (2024)  Overcoming side reaction effects in the colloidal synthesis of ZnSe/ZnS core/shell quantum dots with an etching strategy.  Nano Research,      [PMID:] [10.1007/s12274-024-6732-0]