Boc-Phe-Anthra-OH | 123470-80-4

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: Boc-Phe-Anthra-OH
• 英文别名: 2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]benzoic acid
• CAS: 123470-80-4
• 化学式: C₂₁H₂₄N₂O₅
• 分子量: 384.432
• InChiKey: QYCLFEYMQGULAQ-KRWDZBQOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  28
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  105
• 氢给体数：
  3
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  methyl (S)-2-(2-((tert-butoxycarbonyl)amino)-3-phenylpropanamido)benzoate 在 甲醇 、 sodium hydroxide 作用下， 反应 10.0h， 以91.45%的产率得到Boc-Phe-Anthra-OH
  参考文献：
  名称：

  Conformational Heterogeneity, Self-Assembly, and Gas Adsorption Studies of Isomeric Hybrid Peptides

  摘要：

  The folding and self-assembly propensities of three synthetic isomeric aliphatic aromatic backbone hybrid peptides are illustrated. Single crystal X-ray diffraction studies of three isomeric hybrid dipeptides Boc-Phe-x-aminobenzoic acid (x = o/m/p) reveal that the peptides adopt unconventional conformations which self-assemble to form diverse supramolecular architectures using hydrogen bonding interactions and other noncovalent interactions in the solid state. The N-2 sorption propensities of the isomeric hybrid peptides in the solid state significantly vary with folding and self-assembly nature. The peptides 1 and 2 exhibit type-III N-2 sorption isotherm, though peptide 1 adsorbs 2-fold higher N-2 than does peptide 2.

  DOI：

  10.1021/cg201268x

文献信息

• RENIN INHIBITING PEPTIDES WITH NONPEPTIDE LINKAGES
  申请人：THE UPJOHN COMPANY

  公开号：EP0364493A1

  公开（公告）日：1990-04-25
• [EN] RENIN INHIBITING PEPTIDES WITH NONPEPTIDE LINKAGES
  申请人：THE UPJOHN COMPANY

  公开号：WO1989001488A1

  公开（公告）日：1989-02-23

  (EN) The present invention provides novel renin-inhibiting peptides of the formula X-A6-B7-C8-D9-E10-F11-G12-H13-I14-Z, containing aryl acid derived moieties of the formula XL2b which are substituted for Phe8-His9, X and Z are terminal groups, and the remaining variables are absent or are amino acid residues. Such inhibitors are useful for the diagnosis and control of renin-dependent hypertension and other related diseases.(FR) Nouveaux peptides inhibiteurs de la rénine de formule X-A6-B7-C8-D9-E10-F11-G12-H13-I14-Z, contenant des parties dérivées de l'acide d'aryle de formule XL2b, qui sont substituées au Phe8-His9, X et Z sont des groupes en fin de chaîne, et les variables restantes sont absentes ou bien sont des résidus aminoacides. Ces inhibiteurs sont utiles pour le diagnostic et la maîtrise de l'hypertension liée à la rénine et d'autres maladies apparentées.
• Conformational Heterogeneity, Self-Assembly, and Gas Adsorption Studies of Isomeric Hybrid Peptides
  作者：Sibaprasad Maity、Poulami Jana、Suman Kumar Maity、Pankaj Kumar、Debasish Haldar

  DOI：10.1021/cg201268x

  日期：2012.1.4

  The folding and self-assembly propensities of three synthetic isomeric aliphatic aromatic backbone hybrid peptides are illustrated. Single crystal X-ray diffraction studies of three isomeric hybrid dipeptides Boc-Phe-x-aminobenzoic acid (x = o/m/p) reveal that the peptides adopt unconventional conformations which self-assemble to form diverse supramolecular architectures using hydrogen bonding interactions and other noncovalent interactions in the solid state. The N-2 sorption propensities of the isomeric hybrid peptides in the solid state significantly vary with folding and self-assembly nature. The peptides 1 and 2 exhibit type-III N-2 sorption isotherm, though peptide 1 adsorbs 2-fold higher N-2 than does peptide 2.