86307-44-0

• 常用中文名：Pre-骨化三醇PTAD加合物
• 常用英文名：pre-Calcitriol PTAD Adduct
• CAS号：86307-44-0
• 分子式：C₃₅H₄₉N₃O₅
• 分子量：591.78100
• 相关类别： 信号通路 维生素 D 相关 VD/VDR
• 发布时间：2019-01-04 23:15:22
• 更新时间：2026-06-30 13:42:12
• Impurity C of Calcitriol是Calcitriol的杂质,Calcitriol是维生素D3的活性代谢物,能激活维生素D受体。

名称

• 中文名: Pre-骨化三醇PTAD加合物
• 英文名: pre-Calcitriol PTAD Adduct
• 中文别名: 钙三醇杂质1; PRE-骨化三醇PTAD加合物; 骨化三醇杂质3(骨化三醇杂质C); 骨化三醇杂质C; 骨化三醇杂质 C; 骨化三醇杂质47; 骨化三醇前体的三唑啉加合物; 钙三醇杂质C(非对映混合物)
• 英文别名: 1,25-Dihydroxy Vitamin D3 Impurity C; Calcitriol Impurity 3; IMpurity C of Calcitriol; Calcitriol Impurity 1; (6,7R,9-11-((3S,5R)-3,5-dihydroxy-2-Methylcyclohex-1-en-1-yl)-7-((R)-6-hydroxy-6-Methylhtan-2-yl)-6a-Methyl-2-phenyl-4a,5,6,6a,7,8,9,9a-octahydrocyclopenta[f][1,2,4]triazolo[1,2-a]cinnoline-1,3(2H,11H)-dione; Triazoline Adduct of pre-Calcitriol; Calcitriol Impurity 3(Calcitriol Impurity C); Calcitriol Impurity C (4,11S); (1H,5H-Cyclopenta[f][1,2,4]triazolo[1,2-a]cinnoline-1,3(2H)-dione, 11-(3,5-dihydroxy-2-methyl-1-cyclohexen-1-yl)-4a,6,6a,7,8,9,9a,11-octahydro-7-(5-hydroxy-1,5-dimethylhexyl)-6a-methyl-2-phenyl-, [4-[4aα,6aα,7α(R*),9aβ),11α(3S*,5R*)]]- (9CI); Impurity C of Calcitriol; Calcitriol Impurity C; 1H,5H-Cyclopenta[f][1,2,4]triazolo[1,2-a]cinnoline-1,3(2H)-dione, 11-(3,5-dihydroxy-2-Methyl-1-cyclohexen-1-yl)-4a,6,6a,7,8,9,9a,11-octahydro-7-(5-hydroxy-1,5-diMethylhexyl)-6a-Methyl-2-phenyl-, [4-[4aα,6aα,7α(R*),9aβ,11α(3S*,5R; pre-Calcitriol PTAD Adduct\n\n(Mixture of Diastereomers); Calcitriol Impurity 47; Calcitriol Impurity C(Mixture of Diastereomers); pre-Calcitriol PTAD Adduct/Calcitriol Impurity C/Triazoline adduct of Pre-calcitriol(6,7R,9-11-[(3S,5R)-3,5-dihydroxy-2-methylcyclohex-1-enyl]-7-[(1R)-5-hydroxy-1,5-dimethylhexyl]-6a-methyl-2-phenyl-5,6,6a,7,8,9,9a,11-octahydro-1H,4aH-cyclopenta[f; Rocaltrol Impurity C; [4-[4aα,6aα,7α(R*),9aβ,11α(3S*,5R*)]]-11-(3,5-Dihydroxy-2-Methyl-1-cyclohexen-1-yl)-4a,6,6a,7,8,9,9a,11-octahydro-7-(5-hydroxy-1,5-diMethylhexyl)-6a-Methyl-2-phenyl-1H,5H-cyclopenta[f][1,2,4]triazolo[1,2-a]cinnoline-1,3(2H)-di

物化性质

• 分子式: C₃₅H₄₉N₃O₅
• 分子量: 591.78100
• 精确质量: 591.36700
• PSA: 109.62000
• LogP: 5.05860
• 储存条件: 2-8℃

生物活性

• 描述: Impurity C of Calcitriol是Calcitriol的杂质,Calcitriol是维生素D3的活性代谢物,能激活维生素D受体。
• 相关类别:
  信号通路 >> 维生素 D 相关 >> VD/VDR
  研究领域 >> 癌症
• 参考文献:

  [1]. Canalejo et al (2000) The in vitro effect of calcitriol on parathyroid cell proliferation and apoptosis. J.Am.Soc.Nephrol. 11 1865. Beer and Myrthue (2004)

  [2]. Calcitriol in cancer treatment: from the lab to the clinic. Mol.Cancer Ther. 3 373.

  [3]. Krishnan AV, Swami S, Feldman D.Equivalent anticancer activities of dietary vitamin D and calcitriol in an animal model of breast cancer: Importance of mammary CYP27B1 for treatment and prevention.J Steroid Biochem Mol Biol. 2012 Aug 23.

  [4]. Alkharfy KM, Al-Daghri NM, Yakout SM, Ahmed M. Calcitriol Attenuates Weight-Related Systemic Inflammation and Ultrastructural Changes of the Liver in a Rodent Model.Basic Clin Pharmacol Toxicol. 2012 Aug 21.

合成路线

86307-43-9 ~73% 86307-44-0

文献：Vanmaele, L.; Clerq, P. J. de; Vandewalle, M. Tetrahedron, 1985 , vol. 41, # 1 p. 141 - 144

15988-11-1 ~% 86307-44-0

文献：Tetrahedron, , vol. 41, # 1 p. 141 - 144

23357-18-8 ~% 86307-44-0

文献：Tetrahedron, , vol. 41, # 1 p. 141 - 144

86307-41-7 ~% 86307-44-0

文献：Tetrahedron, , vol. 41, # 1 p. 141 - 144

86307-42-8 ~% 86307-44-0

文献：Tetrahedron, , vol. 41, # 1 p. 141 - 144

86323-06-0 ~% 86307-44-0

文献：Tetrahedron, , vol. 41, # 1 p. 141 - 144

上下游产品

上游产品  6
86307-43-9 15988-11-1 23357-18-8 86307-41-7
86307-42-8 86323-06-0
下游产品  2
32222-06-3 57102-09-7