3-(2-Azidoacetyl)-4-(azidomethyl)-4,7-dimethoxy-7-oxoheptanoic acid

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 酮酸及其衍生物
• 英文名称: 3-(2-Azidoacetyl)-4-(azidomethyl)-4,7-dimethoxy-7-oxoheptanoic acid
• 英文别名: 3-(2-azidoacetyl)-4-(azidomethyl)-4,7-dimethoxy-7-oxoheptanoic acid
• 化学式: C12H18N6O6
• 分子量: 342.31
• InChiKey: PXIBZQMTBSOCCI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  24
• 可旋转键数：
  13
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  119
• 氢给体数：
  1
• 氢受体数：
  10

文献信息

• Synthesis for the preparation of porphobilinogen, the compound as such as stabilized salt and intermediates thereof
  申请人：Neier, Reinhard

  公开号：EP1357110A1

  公开（公告）日：2003-10-29

  The invention relates to a new inventive process sequence of steps a) to e) as claimed in Claim 1 for the preparation of porphobilinogen and intermediates per se as important precursors such as 3-[4-methoxycarbonylmethyl-5-(protected amino-methyl)-1 H-pyrrol-3-yl]-propionic acid methyl ester of formula 7 wherein R is a protective group, and 3-[4-Carboxymethyl-5-(protected amino-methyl)-1 H-pyrrol-3-yl]-propionic acid di-alkali metal salt of formula 8 and especially 3-[4-carboxymethyl-5-(phenylacetyl-amino-methyl)- 1H-pyrrol-3-yl]-propionic acid di-lithium salt of formula 8a and of carboxylate 4-(2-carboxy-ethyl)-3-carboxymethyl-1H-pyrrrol-2-yl-methyl-ammonium of formula 9 and of phenylacetate 4-(2-carboxy-ethyl)-3carboxymethyl-1 H-pyrrol-2-ylmethyl-ammonium of formula 9a and the use thereof for the preparation of porphobilinogen.

  该发明涉及一种新的创新过程步骤序列，即索权项1中所述的步骤a）至e），用于制备卟啉原卟啉和中间体本身，作为重要的前体，例如式7的3-[4-甲氧羰甲基-5-(保护氨基甲基)-1H-吡咯-3-基]-丙酸甲酯，其中R是保护基，以及式8的3-[4-羧甲基-5-(保护氨基甲基)-1H-吡咯-3-基]-丙酸双碱金属盐，特别是式8a的3-[4-羧甲基-5-(苯乙酰氨基甲基)-1H-吡咯-3-基]-丙酸双锂盐，以及式9的羧酸酯4-(2-羧基乙基)-3-羧甲基-1H-吡咯-2-基-甲基铵，以及式9a的苯乙酸酯4-(2-羧基乙基)-3-羧甲基-1H-吡咯-2-基甲基铵，以及其用于制备卟啉原卟啉的用途。
• [EN] A NEW SYNTHESIS FOR THE PREPARATION OF PORPHOBILINOGEN AND THE COMPOUND AS SUCH AS STABILIZED SALT AND INTERMEDIATES THEREOF<br/>[FR] NOUVELLE SYNTHESE POUR LA PREPARATION DE PORPHOBILINOGENE ET COMPOSE EN TANT QUE SEL STABILISE ET SES INTERMEDIAIRES
  申请人：NEIER REINHARD

  公开号：WO2003091210A1

  公开（公告）日：2003-11-06

  The invention relates to a new inventive process sequence of steps (a) to (e) as claimed in Claim 1 for the preparation of porphobilinogen and intermediates per se as important precursors such as 3-[4-methoxycarbonylmethyl-5-(protected amino-methyl)-1H-pyrrol-3-yl]-propionic acid methyl ester of formula 7 wherein R is phenylacetyl group, and 3-[4-Carboxymethyl-5-(protected amino-methyl)-1H-pyrrol-3-yl]-propionic acid di-alkali metal salt of formula 8 and especially 3-[4-carboxymethyl-5-(phenylacetyl-amino-methyl)-1H-pyrrol-3-yl]-propionic acid di-lithium salt of formula 8a.