35418-58-7 (L-Α-磷脂酰胆碱 Β-花生四烯酰-Γ-棕榈酰,1-Palmitoyl-2-arachidoyllecithin)

CAS号:
35418-58-7
中文名称:
L-Α-磷脂酰胆碱 Β-花生四烯酰-Γ-棕榈酰
英文名称:
1-Palmitoyl-2-arachidoyllecithin
分子式:
C44H80NO8P
分子量:
782.08167552948

L-Α-磷脂酰胆碱 Β-花生四烯酰-Γ-棕榈酰(35418-58-7)名称与标识符

名称

中文别名:
1-棕榈酰-2-花生酰卵磷脂;L-Α-磷脂酰胆碱 Β-花生四烯酰-Γ-棕榈酰;
英文别名:
1-Palmitoyl-2-arachidoyllecithin;[(2R)-2-hexadecanoyloxy-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate;1-Palmitoyl-2-arachi;1-hexadecanoyl-2--(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphocholine;20:4(5Z,8Z,11Z,14Z));PAPC;1-hexadecanoyl-2--(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphocholine; PAPC; PC(16:0/20:4(5Z,8Z,11Z,14Z));CHEBI:73003;PC(16:0/20:4);(2R)-3-(hexadecanoyloxy)-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]propyl 2-(trimethylazaniumyl)ethyl phosphate;GPCho(16:0/20:4w6);GPC(16:0/20:4);1-palmitoyl-2-arachidonoyl-GPC;1-Palmitoyl-2-arachidoyllecithin; 3,5,8-Trioxa-4-phosphaoctacosa-13,16,19,22-tetraen-1-aminium, 4-hydroxy-N,N,N-trimethyl-9-oxo-7-[[(1-oxohexadecyl)oxy]methyl]-, inner salt, 4-oxide, (7R,13Z,16Z,19Z,22Z)-; 3,5,8-Trioxa-4-phosphaoctacosa-13,16,19,22-tetraen-1-aminium, 4-hydroxy-N,N,N-trime;SCHEMBL236438;[(2R)-3-hexadecanoyloxy-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate;GPCho(16:0/5Z,8Z,11Z,14Z-20:4);Phosphatidylcholine(16:0/20:4);(2-{[(2R)-3-(hexadecanoyloxy)-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium;2-((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoyloxy)-3-(palmitoyloxy)propyl (2-(trimethylammonio)ethyl) phosphate;35418-58-7;Phosphatidylcholine(16:0/20:4omega6);1-palmitoyl-2-arachidonoyl-sn-glycero-3-phosphocholine;1-Palmitoyl-2-arachidonoylphosphatidylcholine;GPCho(16:0/20:4);PC(16:0/20:4(5Z,8Z,11Z,14Z));PC(16:0/20:4omega6);Q27105003;1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4);PC(16:0/20:4w6);GPCho(16:0/20:4n6);Phosphatidylcholine(16:0/20:4w6);Phosphatidylcholine(16:0/20:4n6);DTXSID201255137;GPCho(16:0/20:4omega6);BP-29915;PD085503;1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phosphocholine;PC(16:0/20:4n6);PC 16:0/24:4(5Z,8Z,11Z,14Z);1ST001062-1000S;CS-0182796;HY-141636;1-Palmitoyl-2-arachidonoyl-sn-glycero-3-phosphocholine Solution in Chloroform, 1000ug/mL;

标识符

InChIKey:
IIZPXYDJLKNOIY-JXPKJXOSSA-N
Inchi:
1S/C44H80NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h14,16,20-21,23,25,29,31,42H,6-13,15,17-19,22,24,26-28,30,32-41H2,1-5H3/b16-14-,21-20-,25-23-,31-29-/t42-/m1/s1
SMILES:
P(=O)([O-])(OC[C@@H](COC(CCCCCCCCCCCCCCC)=O)OC(CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)OCC[N+](C)(C)C

L-Α-磷脂酰胆碱 Β-花生四烯酰-Γ-棕榈酰(35418-58-7)物化性质

实验特性

  • 浓度 : 10 mg/mL (850459C-25mg)
    25 mg/mL (850459C-200mg)

计算特性

  • 精确分子量 : 781.56215551g/mol
  • 氢键供体数量 : 0
  • 氢键受体数量 : 8
  • 可旋转化学键数量 : 40
  • 同位素质量 : 781.56215551g/mol
  • 重原子数量 : 54
  • 复杂度 : 1060
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 1
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 4
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 12.6
  • 拓扑分子极性表面积 : 111Ų

L-Α-磷脂酰胆碱 Β-花生四烯酰-Γ-棕榈酰(35418-58-7)安全信息

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L-Α-磷脂酰胆碱 Β-花生四烯酰-Γ-棕榈酰(35418-58-7)参考资料

Reaxys RN:
PubChem CID: