Pentacosanoic acid - ≥98% , CAS No.506-38-7

CAS: 506-38-7 Cat. No.: P420194 Formule: C₂₅H₅₀O₂ Poids moléculaire: 382.66 Numéro CE: 208-036-0

QUALITÉ & PURETÉ ≥98%

Synonyms

Hyenate | n-Pentacosanoic acid | PENTACOSANOIC ACID | Q4348644 | 562AA15C-C8EA-4109-ABAF-D8CC68CCB7C8 | FA 25:0 | CHEBI:39420 | n-Pentacosanoate | AS-35339 | 4S768OX95G | NSC89289 | NSC-89289 | EINECS 208-036-0 | SCHEMBL2054087 | AKOS015839858 | HY-124422

Storage

Room temperature,Desiccated

Shipped In

Normal

Spécifications

Synonymes

Hyenate | n-Pentacosanoic acid | PENTACOSANOIC ACID | Q4348644 | 562AA15C-C8EA-4109-ABAF-D8CC68CCB7C8 | FA 25:0 | CHEBI:39420 | n-Pentacosanoate | AS-35339 | 4S768OX95G | NSC89289 | NSC-89289 | EINECS 208-036-0 | SCHEMBL2054087 | AKOS015839858 | HY-124422

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Room temperature,Desiccated

Expédié en

Normal

Pureté

≥98%

Noms et identifiants

Pubchem Sid

528769592

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528769592

Sourires canoniques

CCCCCCCCCCCCCCCCCCCCCCCCC(=O)O

IUPAC Name

pentacosanoic acid

InChIKey

MWMPEAHGUXCSMY-UHFFFAOYSA-N

INCHI

1S/C25H50O2/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/h2-24H2,1H3,(H,26,27)

Isomères SMILES

CCCCCCCCCCCCCCCCCCCCCCCCC(=O)O

Poids moléculaire

382.66

Reaxy-Rn

1797903

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1797903&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: 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
• Description: 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

Cibles associées (non humaines)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

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

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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

Mécanismes d'action

Propriétés chimiques et physiques

• Point de fusion (°C): 83°C
• Poids moléculaire: 382.700 g/mol
• XLogP3: 11.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 23
• Exact Mass: 382.381 Da
• Monoisotopic Mass: 382.381 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 27
• Formal Charge: 0
• Complexity: 288.000
• 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