(4-Formyl-5-hydroxy-6-methylpyridin-3-yl)methyl dihydrogen phosphate hydrate 磷酸-5-吡哆醛一水合物

CAS 41468-25-1 MFCD00006333

化学结构图

41468-25-1
SMILES: Cc1ncc(COP(=O)(O)O)c(C=O)c1O.O

化学属性

Mol. FormulaC8H10NO6P·H2O
Mol. Weight247.14(as Anhydrous)
Melting Point140-143 °C
Appearance powder 50 (大鼠,经口)5900 mg/kg。 白色结晶性粉末,无气味,在碱性溶液中呈亮黄色。水溶液避光低温稳定,见光渐分解。易溶于甲酸、含水吡啶和稀碱液,微溶于水、乙醇、丙酮、氯仿和乙醚等有机溶剂。LD
Density1.638

别名和识别编码

Chemical Name(4-Formyl-5-hydroxy-6-methylpyridin-3-yl)methyl dihydrogen phosphate hydrate
Synonym CODECARBOXYLASE hairoxal Pyridoxal 5'-phosphate hydrate 吡多醛磷酸酯 磷酸吡哆醛 3-hydroxy-2-methyl-5-((phosphonooxy)methyl)-4-pyridinecarboxaldehyd PYRIDOXAL 5'-MONOPHOSPHATE PYRIDOXAL-5-PHOSPHORIC ACID pal-p hexerminp phosphoridoxalcoenzyme biosechs PYRIDOXAL 5'-PHOSPHATE 3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]-4-PYRIDINECARBOXALDEHYDE Codecarboxylase 3-羟基-2-甲基-5-[(磷酰氧基)甲基]-4-吡啶甲醛 吡哆醛 5-磷酸酯 hi-pyridoxin 3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]-4-pyridinecarboxaldehyd 3-羟基-2-甲基-5-[(膦羧基)甲基]-4-吡啶醛,3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]4-PYRINECAR-BOXALDEHYDE 吡多醛-5-磷酸酯 piodel PYRIDOXAL 5-PHOSPHATE phosphopyridoxal VITAMIN B6 3-Hydroxy-2-methyl-5-([phosphonooxy]methyl)-4-pyridinecarboxaldehyde Codecarboxylase PLP Pyridoxal 5-phosphate Pyridoxal phosphate 3-Hydroxy-2-methyl-5-([phosphonooxy]methyl)-4-pyridinecarboxaldehyde Codecarboxylase PLP Pyridoxal 5-phosphate 3-Hydroxy-5-(hydroxymethyl)-2-methylisonicotinaldehyde 5-phosphate
MDL NumberMFCD00006333
Beilstein Registry Number234749
EC Number200-208-3
PubChem Substance ID87565509
Reaxys-RN234749
CAS Number41468-25-1
Merck Number7979
Chemical Name Translation磷酸-5-吡哆醛一水合物
Wiswesser Line NotationT6NJ B1 CQ DVH E1OPQQO &QH
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分类

  • {SNA} Aldehydes, Building Blocks, C8, Carbonyl Compounds, Chemical Synthesis, Organic Building Blocks, Vitamin B, Vitamin B6, Vitamins, 细胞生物学, 营养研究
  • {SNA} Aldehydes, Building Blocks, C8, Carbonyl Compounds, Chemical Synthesis, Cofactors, Organic Building Blocks, Other Cofactors, Vitamin B, Vitamin B6, Vitamins, 生化试剂, 细胞生物学, 营养研究, 酶、抑制剂和底物
  • {SNA} Aldehydes, Biochemicals and Reagents,
  • {Chemicalbook} 生物化学品: 生化试剂: 辅酶和维生素

产品应用

  • 酶辅助因子, Vitamin B6的正常辅酶形式。

安全信息

WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
RTECSUV1208000
Storage condition -20°C 储存温度 -20°C
Safety Statements
GHS Symbol
Precautionary statements
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 870 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 11,922,1961

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 5900 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - excitement
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 11,922,1961

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 4640 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 11,922,1961

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 850 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - excitement
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 11,922,1961

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其他信息

  • 磷酸吡哆醛价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 67001332 磷酸-5’-吡哆醛(+4℃) 5g 50元
  • 图谱信息:磷酸吡哆醛(54-47-7)红外图谱(IR2) 磷酸吡哆醛(54-47-7)红外图谱(IR1)
  • 用途一:生化研究,孕甾酮特性的结构修饰,酶抑制剂。
  • 用途二:维生素B6的主体药物,适用于治疗急慢性湿疹、皮肤炎、荨麻诊、脓疱疹、搔痒症、脂溢性湿疹、鳞屑疹、药疹、口角炎、口唇炎、舌炎、妊娠反应、哮喘等。该品实际上无毒,大鼠口服LD50为6g/kg。
  • 上游原料:二氧化锰 --> 五氧化二磷 --> 磷酸酯 --> 吡多素 --> 盐酸吡多胺
  • 方法一:吡哆胺二盐酸盐与无水磷酸反应成吡哆胺磷酸酯,后者再经二氧化锰氧化制得。
  • MSDS 信息:3-Hydroxy-2-methyl-5-[(phosphonooxy)methyl]-4-pyridinecarboxaldehyde(54-47-7).msds
  • Sigma Aldrich:54-47-7(sigmaaldrich)
  • 下游产品:4-脱氧吡哆醇盐酸盐
  • F:8-10-23
  • 参考质量标准:紫外光谱检测合格。
  • 方法二:以吡哆醇为原料。
  • MOL 文件:54-47-7.mol

系列性分类