16-Hydroxyhexadecansäure - ≥98%(T) , CAS No.506-13-8

CAS: 506-13-8 Cat. No.: H157149 Summenformel: C₁₆H₃₂O₃ Molekulargewicht: 272.43 Beilstein Registry Number: 1784000

GRADE & PURITY ≥98%(T)

Synonyms

16-hydroxy hexadecanoic acid | hydroxy hexadecanoate | hydroxy hexadecanoic acid | NSC-159292 | AS-47314 | F13220 | SY057066 | Hexadecanoic acid, 16-hydroxy- | omega hydroxy hexadecanoic acid | FT-0607251 | .omega.-Hydroxypalmitic acid | 16-Hydoxy hexadec

Storage

Room temperature

Shipped In

Normal

Übersicht

Wird in der Regel für die Synthese von Dihydroxypalmitinsäuren verwendet und dient auch zur Induktion der Expression von zwei GRP-Genen von Arabidopsis thaliana, AtGRP5 und AtGRP23.

Specifications

Synonyme

16-hydroxy hexadecanoic acid | hydroxy hexadecanoate | hydroxy hexadecanoic acid | NSC-159292 | AS-47314 | F13220 | SY057066 | Hexadecanoic acid, 16-hydroxy- | omega hydroxy hexadecanoic acid | FT-0607251 | .omega.-Hydroxypalmitic acid | 16-Hydoxy hexadec

Spezifikationen & Reinheit

≥98%(T)

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%(T)

Namen und Kennungen

• Pubchem Sid: 528754874
• Kanonisches Lächeln: C(CCCCCCCC(=O)O)CCCCCCCO
• IUPAC Name: 16-hydroxyhexadecanoic acid
• InChIKey: UGAGPNKCDRTDHP-UHFFFAOYSA-N
• INCHI: 1S/C16H32O3/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(18)19/h17H,1-15H2,(H,18,19)
• Isomere SMILES: C(CCCCCCCC(=O)O)CCCCCCCO
• WGK Deutschland: 3
• Molekulargewicht: 272.43
• Beilstein: 1784000
• Reaxy-Rn: 1783998
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1783998&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Klasse: Fatty Acyls
• Subclass: Fatty acids and conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Long-chain fatty acids
• Alternative Parents: Hydroxy fatty acids Straight chain fatty acids Monocarboxylic acids and derivatives Carboxylic acids Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Long-chain fatty acid - Hydroxy fatty acid - Straight chain fatty acid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound
• Beschreibung: 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: Hydroxy 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

Zugehörige Ziele (menschlich)

FFAR1 Tchem Free fatty acid receptor 1 (4763 Activities)

Discover Target: FFAR1

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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Light Sensitive
• Schmelzpunkt (°C): 94-100℃
• Molekulargewicht: 272.420 g/mol
• XLogP3: 4.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 15
• Exact Mass: 272.235 Da
• Monoisotopic Mass: 272.235 Da
• Topological Polar Surface Area: 57.500 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 192.000
• 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