Description

This specialized chemical compound, palmitoyl-Val-ol.Unk-Val-ol.oleoyl-Leu-ol.oleoyl-Val-ol.Unk-Val-ol (CAS: 1198787-91-5), is a meticulously synthesized lipid-peptide conjugate with the molecular formula C₁₁₅H₂₂₅N₅O₁₁. Its structure comprises multiple fatty acid chains (palmitoyl and oleoyl) conjugated to valinol and leucinol derivatives, offering unique amphiphilic properties. The IUPAC name reflects its complex composition: N-(1-hydroxy-3-methylbutan-2-yl)hexadecanamide; N-(1-hydroxy-3-methylbutan-2-yl)octadeca-9,12-dienamide; N-(1-hydroxy-3-methylbutan-2-yl)octadec-9-enamide; N-(1-hydroxy-4-methylpentan-2-yl)octadec-9-enamide; octadec-9-enyl N-(1-hydroxy-3-methylbutan-2-yl)carbamate. This high-purity product is ideal for advanced research in lipidomics, membrane biophysics, and drug delivery systems, where tailored lipid-peptide interactions are critical. Available in precise quantities, it is characterized by HPLC and mass spectrometry to ensure consistency for experimental reproducibility.

Properties

• CAS Number: 1198787-91-5
• Complexity: 1710
• IUPAC Name: N-[1-(hydroxymethyl)-3-methyl-butyl]octadec-9-enamide;N-[1-(hydroxymethyl)-2-methyl-propyl]hexadecanamide;N-[1-(hydroxymethyl)-2-methyl-propyl]octadeca-9,12-dienamide;N-[1-(hydroxymethyl)-2-methyl-propyl]octadec-9-enamide;octadec-9-enyl N-[1-(hydroxymethyl)-2-methyl-propyl]carbamate
• InChI: InChI=1S/C24H47NO3.C24H47NO2.C23H45NO2.C23H43NO2.C21H43NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28-24(27)25-23(21-26)22(2)3;1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24(27)25-23(21-26)20-22(2)3;2*1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)24-22(20-25)21(2)3;1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)22-20(18-23)19(2)3/h11-12,22-23,26H,4-10,13-21H2,1-3H3,(H,25,27);11-12,22-23,26H,4-10,13-21H2,1-3H3,(H,25,27);11-12,21-22,25H,4-10,13-20H2,1-3H3,(H,24,26);8-9,11-12,21-22,25H,4-7,10,13-20H2,1-3H3,(H,24,26);19-20,23H,4-18H2,1-3H3,(H,22,24)
• InChI Key: IZHHSLJOCTYGQM-UHFFFAOYSA-N
• Exact Mass: 1853.72341785
• Molecular Formula: C115H225N5O11
• Molecular Weight: 1854.0
• SMILES: CCCCCCCCCCCCCCCC(=O)NC(CO)C(C)C.CCCCCCCCC=CCCCCCCCCOC(=O)NC(CO)C(C)C.CCCCCCCCC=CCCCCCCCC(=O)NC(CC(C)C)CO.CCCCCCCCC=CCCCCCCCC(=O)NC(CO)C(C)C.CCCCCC=CCC=CCCCCCCCC(=O)NC(CO)C(C)C
• Topological: 256
• Monoisotopic Mass: 1852.72006301
• Synonyms: palmitoyl-Val-ol.Unk-Val-ol.oleoyl-Leu-ol.oleoyl-Val-ol.Unk-Val-ol, 1198787-91-5

Application

This compound is primarily used in lipid-based drug delivery research, where its hybrid structure facilitates studies on cellular uptake and membrane permeability. It serves as a model for investigating lipopeptide self-assembly in nanocarrier formulations. Researchers also employ it in biophysical studies of lipid-protein interactions due to its mixed fatty acid and amino alcohol moieties.

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