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1,2-dioctanoyl-sn-glycero-3-phosphocholine | 19191-91-4

1,2-dioctanoyl-sn-glycero-3-phosphocholine
3,5,9-Trioxa-4-phosphaheptadecan-1-aminium,4-hydroxy-N,N,N-trimethyl-10-oxo-7-[(1-oxooctyl)oxy]-, inner salt, 4-oxide,(7R)-
19191-91-4
C24H48NO8P
509.613589286804
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:1,2-dioctanoyl-sn-glycero-3-phosphocholine结构式
24779244
名称和标识符
MDL MFCD00082429
InChIKey YHIXRNNWDBPKPW-JOCHJYFZSA-N
Inchi InChI=1S/C24H48NO8P/c1-6-8-10-12-14-16-23(26)30-20-22(33-24(27)17-15-13-11-9-7-2)21-32-34(28,29)31-19-18-25(3,4)5/h22H,6-21H2,1-5H3/t22-/m1/s1
SMILES CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC
别名信息
- 中文别名 -
  • 3-二(辛酰氧基)丙基2-(三甲基铵基)乙基磷酸酯
- 英文别名 -
  • 3,5,9-Trioxa-4-phosphaheptadecan-1-aminium,4-hydroxy-N,N,N-trimethyl-10-oxo-7-[(1-oxooctyl)oxy]-, inner salt, 4-oxide,(7R)-
  • 1,2-dioctanoyl-sn-glycero-3-phosphocholine
  • 1,2-Dioctanoyl PC
  • [O-(1-O,2-O-Dioctanoyl-L-glycero-3-phospho)choline]anion
  • 1,2-dicaproyl-sn-glycero-3-phosphocholine
  • 1,2-dicapryloylphosphatidylcholine
  • 1,2-Dioctanoyl-L-3-phosphatidylcholine
  • Dicapryloylphosphatidylcholine
  • Dioctanoylphosphatidylcholine
  • L-A-PHOSPHATIDYLCHOLINE, DIOCTANOYL
  • L-Dioctanoylphosphatidylcholine
  • Dicapryloyl-L-α-lecithin
  • Dioctanoyl-L-α-phosphatidylcholine
  • L-α-Phosphatidylcholine, dioctanoyl
  • Dioctanoyl-L-α-glycerophosphorylcholine
  • (R)-2,3-Bis(octanoyloxy)propyl (2-(trimethylammonio)ethyl) phosphate
  • Q27105079
  • PD019632
  • 3,5,9-Trioxa-4-phosphaheptadecan-1-aminium, 4-hydroxy-N,N,N-trimethyl-10-oxo-7-[(1-oxooctyl)oxy]-, inner salt, 4-oxide, (R)-
  • YHIXRNNWDBPKPW-JOCHJYFZSA-N
  • Dioctanoyl-L-alpha-glycerophosphorylcholine
  • SCHEMBL418427
  • 19191-91-4
  • 1,2-Dioctanoyl-sn-glycerol-3-phosphocholine
  • A12199
  • PC 8:0/8:0
  • 1,2-Bis(O-octanoyl)-sn-glycerylphophorylcholine
  • (2R)-2,3-bis(octanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
  • 1,2-Dioctanoyl-sn-glycero-3-phosphocholine
  • BP-29621
  • 1,2-dicapryloyl-sn-glycero-3-phosphocholine
  • Dioctanoyl-L-alpha-phosphatidylcholine
  • CHEBI:78228
  • AKOS027320737
  • PC(8:0/8:0)
  • Octanoin, 1,2-di-, dihydrogen phosphate, monoester with choline hydroxide, inner salt, L-
  • CS-0092501
  • AS-62204
  • 08:0 PC, 1,2-dioctanoyl-sn-glycero-3-phosphocholine, powder
  • DTXSID201334462
  • [(2R)-2,3-di(octanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
  • Dicapryloyl-L-alpha-lecithin
  • CHEMBL4533579
  • Choline, hydroxide, dihydrogen phosphate, inner salt, ester with 1,2-dioctanoin, L-
  • HY-125619
  • (2-{[(2R)-2,3-bis(octanoyloxy)propyl phosphonato]oxy}ethyl)trimethylazanium
  • LMGP01011251
  • (R)-2,3-Bis(octanoyloxy)propyl(2-(trimethylammonio)ethyl)phosphate
  • NS00073973
物化性质
实验特性
浓度 10 mg/mL (850315C-25mg)
计算特性
精确分子量 509.31175449g/mol
氢键供体数量 0
氢键受体数量 8
可旋转化学键数量 24
同位素质量 509.31175449g/mol
重原子数量 34
复杂度 586
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 0
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) 4.8
拓扑分子极性表面积 111Ų
安全信息
危险品运输编号 NONH for all modes of transport
储存条件 −20°C
专业数据库参考
PubChemId 24779244
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