PALDA , CAS No.136181-87-8

CAS: 136181-87-8 Cat. No.: P340925 Summenformel: C₂₄H₄₁NO₃ Molekulargewicht: 391.6 PubChem CID: 16759163

Synonyms

Hexadecanamide,N-[2-(3,4-dihydroxyphenyl)ethyl]- | NCGC00092335-04 | J-006818 | Palmitoyl dopamine | Hexadecanamide, N-[2-(3,4-dihydroxyphenyl)ethyl]- | HMS3650I11 | PALDA | SCHEMBL875454 | CHEBI:134058 | HMS3268B22 | Q27164120 | SR-01000946793 | N-hexade

Storage

Store at 2-8°C

Shipped In

Wet ice

Übersicht

PALDA is an endogenous fatty acid dopamide that displays 'entourage' effects on endovanilloids NADA and anandamide. PALDA is inactive at TRPV1 and CB1 receptors (at concentrations up to 5 μM) and does not inhibit AMT or FAAH (IC|50|> 25 μM). PALDA additionally potentiates TRPV1-mediated effects of NADA and lowers EC|50|from ~ 90 to ~ 30 nM.

Spezifikationen

Synonyme

Hexadecanamide,N-[2-(3,4-dihydroxyphenyl)ethyl]- | NCGC00092335-04 | J-006818 | Palmitoyl dopamine | Hexadecanamide, N-[2-(3,4-dihydroxyphenyl)ethyl]- | HMS3650I11 | PALDA | SCHEMBL875454 | CHEBI:134058 | HMS3268B22 | Q27164120 | SR-01000946793 | N-hexade

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Aktionsart

ACTIVATOR

Produkteigenschaften

pKa

pKₐ: 9.79 (Predicted)

Namen und Kennungen

Kanonisches Lächeln

CCCCCCCCCCCCCCCC(=O)NCCC1=CC(=C(C=C1)O)O

IUPAC Name

N-[2-(3,4-dihydroxyphenyl)ethyl]hexadecanamide

InChIKey

TWJJFOWLTIEYFO-UHFFFAOYSA-N

INCHI

1S/C24H41NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-24(28)25-19-18-21-16-17-22(26)23(27)20-21/h16-17,20,26-27H,2-15,18-19H2,1H3,(H,25,28)

Isomere SMILES

CCCCCCCCCCCCCCCC(=O)NCCC1=CC(=C(C=C1)O)O

PubChem CID

16759163

Molekulargewicht

391.6

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Phenols
      • Subclass Benzenediols
        • Ebene5 Catechols
          • Ebene6 Catecholamines and derivatives
            • Ebene7 N-acyldopamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Phenols
• Subclass: Benzenediols
• Intermediate Tree Nodes: Catechols - Catecholamines and derivatives
• Direct Parent: N-acyldopamines
• Alternative Parents: 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids N-acyl amines Benzene and substituted derivatives Secondary carboxylic acid amides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: N-acyldopamine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Fatty acyl - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as n-acyldopamines. These are aromatic heterocyclic compounds containing a dopamine, in which the amine group is acylated.
• 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

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in DMSO (~20 mg/ml), DMF (~20 mg/ml), and ethanol (5 mM).
• Brechungsindex: n20D1.52 (Predicted)
• Siedepunkt (°C): 589.55° C at 760 mmHg (Predicted)
• Molekulargewicht: 391.600 g/mol
• XLogP3: 6.600
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 17
• Exact Mass: 391.309 Da
• Monoisotopic Mass: 391.309 Da
• Topological Polar Surface Area: 69.600 Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 375.000
• 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

Häufig gestellte Fragen

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 136181-87-8, the molecular formula is C24H41NO3, and the molecular weight is 391.6 g/mol. InChIKey TWJJFOWLTIEYFO-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.