[(2R)-2-棕榈酰氧基-3-[羟基-[(1S,2R,3S,4S,5R,6R)-2,3,4,6-四羟基-5-膦酰氧基环己基]氧基磷酰]氧基丙基]棕榈酸酯
[CAS# 165689-81-6]

基本信息

• 产品名称: [(2R)-2-棕榈酰氧基-3-[羟基-[(1S,2R,3S,4S,5R,6R)-2,3,4,6-四羟基-5-膦酰氧基环己基]氧基磷酰]氧基丙基]棕榈酸酯
• 英文名: [(2R)-2-Hexadecanoyloxy-3-[Hydroxy-[(1S,2R,3S,4S,5R,6R)-2,3,4,6-Tetrahydroxy-5-Phosphonooxycyclohexyl]Oxyphosphoryl]Oxypropyl] Hexadecanoate
• 别名: [(2R)-2-Hexadecanoyloxy-3-[Hydroxy-[(1S,2R,3S,4S,5R,6R)-2,3,4,6-Tetrahydroxy-5-Phosphonooxy-Cyclohexoxy]Phosphoryl]Oxy-Propyl] Hexadecanoate; Hexadecanoic Acid [(2R)-3-[Hydroxy-[(1S,2R,3S,4S,5R,6R)-2,3,4,6-Tetrahydroxy-5-Phosphonooxycyclohexoxy]Phosphoryl]Oxy-2-(1-Oxohexadecoxy)Propyl] Ester; Palmitic Acid [(2R)-2-Hexadecanoyloxy-3-[Hydroxy-[(1S,2R,3S,4S,5R,6R)-2,3,4,6-Tetrahydroxy-5-Phosphonooxy-Cyclohexoxy]Phosphoryl]Oxy-Propyl] Ester
• 分子式: C₄₁H₈₀O₁₆P₂
• 分子量: 891.02
• CAS 登录号: 165689-81-6
• 分子行输入简码 SMILES: [C@@H]1(O[P](OC[C@H](OC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)(=O)O)[C@H](O)[C@H](O[P](=O)(O)O)[C@@H](O)[C@H](O)[C@H]1O
• 国际化学标识码 InChI: 1S/C41H80O16P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(42)53-31-33(55-35(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)32-54-59(51,52)57-41-38(46)36(44)37(45)40(39(41)47)56-58(48,49)50/h33,36-41,44-47H,3-32H2,1-2H3,(H,51,52)(H2,48,49,50)/t33-,36+,37+,38-,39-,40-,41+/m1/s1
• 国际化学标识检索码 InChIKey: SZPQTEWIRPXBTC-KFOWTEFUSA-N

物理化学性质

• 密度: 1.212g/cm³ （计算值）
• 沸点: 921.092°C at 760 mmHg （计算值）
• 闪点: 510.858°C （计算值）