CAS 132196-28-2

3,5,8-Trioxa-4-phosphaoctacosa-13,16,19,22,25-pentaen-1-aminium, 7-[(hexadecyloxy)methyl]-4-hydroxy-N,N,N-trimethyl-9-oxo-, inner salt, 4-oxide, (7R,13Z,16Z,19Z,22Z,25Z)-

Description:

The chemical substance known as "3,5,8-Trioxa-4-phosphaoctacosa-13,16,19,22,25-pentaen-1-aminium, 7-[(hexadecyloxy)methyl]-4-hydroxy-N,N,N-trimethyl-9-oxo-, inner salt, 4-oxide, (7R,13Z,16Z,19Z,22Z,25Z)-" with CAS number 132196-28-2 is a complex organic compound characterized by its unique structural features, including multiple functional groups and a long hydrocarbon chain. This compound contains a phosphorous atom, which contributes to its phosphonium nature, and features a series of double bonds that suggest it may exhibit significant reactivity and potential for conjugation. The presence of hydroxyl and oxo groups indicates potential for hydrogen bonding and reactivity with nucleophiles. Its inner salt form suggests that it may exist in a zwitterionic state, which can influence its solubility and interaction with biological systems. The long hexadecyl chain implies amphiphilic properties, making it potentially useful in applications such as surfactants or drug delivery systems. Overall, the compound's intricate structure and functional diversity suggest a range of potential applications in fields such as medicinal chemistry and materials science.

Formula: C₄₄H₈₀NO₇P

InChI: InChI=1S/C44H80NO7P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-44(46)52-43(42-51-53(47,48)50-40-38-45(3,4)5)41-49-39-36-34-32-30-28-26-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,24-25,29,31,43H,6-7,9,11-13,15,17-19,21,23,26-28,30,32-42H2,1-5H3/b10-8-,16-14-,22-20-,25-24-,31-29-/t43-/m1/s1

InChI key: InChIKey=YHSSHPWVFALMBA-IARQOZKNSA-N

SMILES: [C@H](OC(CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)(COP(OCC[N+](C)(C)C)(=O)[O-])COCCCCCCCCCCCCCCCC

Synonyms:

• 1-O-Hexadecyl-2-O-(5Z,8Z,11Z,14Z,17Z-Eicosapentaenoyl)-Sn-Glyceryl-3-Phosphorylcholine
• 1-O-Palmityl-2-(cis-5,8,11,14,17-eicosapentaenoyl)-sn-glycero-3-phosphocholine
• 3,5,8-Trioxa-4-phosphaoctacosa-13,16,19,22,25-pentaen-1-aminium, 7-[(hexadecyloxy)methyl]-4-hydroxy-N,N,N-trimethyl-9-oxo-, inner salt, 4-oxide, (7R,13Z,16Z,19Z,22Z,25Z)-
• 3,5,8-Trioxa-4-phosphaoctacosa-13,16,19,22,25-pentaen-1-aminium, 7-[(hexadecyloxy)methyl]-4-hydroxy-N,N,N-trimethyl-9-oxo-, inner salt, 4-oxide, [R-(all-Z)]-
• C16-20:5 Pc
• Eicosapentaenoyl Paf C-16
• L-A-Phosphatidylcholine, B-*(Cis-5,8,11,14,17-
• L-α-Phosphatidylcholine, β-(cis-5,8,11,14,17-eicosapentaenoyl)-γ-O-hexadecyl

1-O-hexadecyl-2-Eicosapentaenoyl-sn-glycero-3-PC

CAS: 132196-28-2

"1-O-Hexadecyl-2-eicosapentaenoyl-sn-glycero-3-PC is a compound that results from the incorporation of eicosapentaenoic acid (EPA) into lyso-PAF C-16, a process demonstrated in neutrophils from monkeys and humans consuming a diet rich in fish oils. Furthermore, it functions as a precursor for PAF C-16 synthesis via the remodeling pathway."

Formula: C₄₄H₈₀NO₇P

Color and Shape: Solid

Molecular weight: 766.1

Ref: TM-T84612