sodium 2-(2-hydroxy-3-pentylphenyl)acetate | 1254580-32-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: sodium 2-(2-hydroxy-3-pentylphenyl)acetate
• 英文别名: Sodium;2-(2-hydroxy-3-pentylphenyl)acetate
• CAS: 1254580-32-9
• 化学式: C₁₃H₁₇O₃*Na
• 分子量: 244.266
• InChiKey: LVLSLRLPHIPVAL-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  -1.58
• 重原子数：
  17
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  60.4
• 氢给体数：
  1
• 氢受体数：
  3

文献信息

• [EN] SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE PREVENTION AND TREATMENT OF OSTEOPOROSIS<br/>[FR] COMPOSÉS AROMATIQUES SUBSTITUÉS ET COMPOSITIONS PHARMACEUTIQUES POUR LA PRÉVENTION ET LE TRAITEMENT DE L'OSTÉOPOROSE
  申请人：PROMETIC BIOSCIENCES INC

  公开号：WO2016054728A1

  公开（公告）日：2016-04-14

  The present invention concerns the use of compounds for preventing and/or treating osteoporosis, for stimulating bone formation, for stimulating bone remodeling, for stimulating the differentiation and mineralization of osteoblasts, for inhibiting bone resorption and for modulating serum level of adiponectin in a subject. These uses have been found for compounds represented by Formula I and pharmaceutically acceptable salts thereof. wherein A is C5 alkyl, C6 alkyl, C5 alkenyl, C6 alkenyl, C(O)-(CH2)n-CH3 or CH(OH)-(CH2)n-CH3 wherein n is 3 or 4; R1 is H, F or OH; R2 is H, F, OH, C6 alkyl, C5 alkenyl, C6 alkenyl, C(O)-(CH2)n-CH3 or CH(OH)-(CH2)n-CH3 wherein n is 3 or 4; R3 is H, F, OH or CH2Ph; R4 is H, F, or OH; Q is 1) (CH2)mC(O)OH wherein m is 1 or 2, 2) CH(F)-C(O)OH, 3) CF2-C(O)OH or 4) C(O)-C(O)OH.

  本发明涉及用于预防或治疗骨质疏松症、刺激骨骼形成、刺激骨骼重塑、刺激成骨细胞的分化和矿化、抑制骨吸收以及调节受试者血清中脂联素水平的化合物的用途。已经发现，这些用途适用于由公式I表示的化合物及其药用可接受的盐。其中A是C5烷基、C6烷基、C5烯基、C6烯基、C(O)-(CH2)n-CH3或CH(OH)-( )n- ，其中n是3或4；R1是H、F或OH；R2是H、F、OH、C6烷基、C5烯基、C6烯基、C(O)-( )n- 或CH(OH)-( )n- ，其中n是3或4；R3是H、F、OH或 Ph；R4是H、F或OH；Q是1) ( )mC(O)OH，其中m是1或2，2) CH(F)-C(O)OH，3) CF2-C(O)OH或4) C(O)-C(O)OH。
• [EN] SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR TISSUE SELF-REPAIR AND REGENERATION<br/>[FR] COMPOSÉS AROMATIQUES SUBSTITUÉS ET COMPOSITIONS PHARMACEUTIQUES POUR AUTO-RÉPARATION ET RÉGÉNÉRATION DE TISSU
  申请人：PROMETIC BIOSCIENCES INC

  公开号：WO2016074068A1

  公开（公告）日：2016-05-19

  Described herein are compounds of Formula I, or pharmaceutically acceptable salts thereof, or combinations thereof, as well as uses thereof. Such uses include promoting tissue self-repair or tissue regeneration of an organ, stimulating the generation of tissue growth, modulating (e.g. increasing) the level of a tissue-repair marker, treating physical injury in an organ, tissue, or cell, promoting wound healing as well as anti-aging applications. Corresponding compositions, methods and uses are also described. Formula I wherein A is C5 alkyl, C6 alkyl, C5 alkenyl, C6 alkenyl, C(0)-(CH2)n-CH3 or CH(OH)-(CH2)n-CH3 wherein n is 3 or 4; R1 is H, F of OH; R2 is H, F, OH, C5 alkyl, C6 alkyl, C5 alkenyl, C6 alkenyl, C(0)-(CH2)n-CH3 or CH(OH)-(CH2)n-CH3 wherein n is 3 or 4; R3 is H, F, OH, or CH2Ph; R4 is H, F or OH; Q is 1) (CH2),C(0)OH wherein m is 1 or 2 2) CH(CH3)C(0)OH, 3) C(CH3)2C(0)OH, 4) CH(F)-C(0)OH, 5) CF2-C(0)OH or 6) C(0)-C(0)OH.

  以下是公式I的化合物，或其药用可接受的盐，或它们的组合，以及它们的用途。这些用途包括促进器官的组织自我修复或组织再生，刺激组织生长的生成，调节（例如增加）组织修复标志物的水平，治疗器官、组织或细胞的物理损伤，促进伤口愈合以及抗衰老应用。还描述了相应的组合物、方法和用途。公式I中，A是C5烷基，C6烷基，C5烯基，C6烯基，C(0)-(CH2)n-CH3或CH(OH)-( )n- ，其中n为3或4；R1是H，F或OH；R2是H，F，OH，C5烷基，C6烷基，C5烯基，C6烯基，C(0)-( )n- 或CH(OH)-( )n- ，其中n为3或4；R3是H，F，OH或 Ph；R4是H，F或OH；Q是1）（ ）mC(0)OH，其中m为1或2 2）CH( )C(0)OH，3）C( )2C(0)OH，4）CH(F)-C(0)OH，5）CF2-C(0)OH或6）C(0)-C(0)OH。
• [EN] SUBSTITUTED AROMATIC COMPOUNDS FOR THE TREATMENT OF PULMONARY FIBROSIS, LIVER FIBROSIS, SKIN FIBROSIS AND CARDIAC FIBROSIS<br/>[FR] COMPOSÉS AROMATIQUES SUBSTITUÉS POUR TRAITEMENT DE LA FIBROSE PULMONAIRE, DE LA FIBROSE HÉPATIQUE, DE LA FIBROSE CUTANÉE ET DE FIBROSE CARDIAQUE
  申请人：PROMETIC BIOSCIENCES INC

  公开号：WO2014138907A1

  公开（公告）日：2014-09-18

  The present invention relates to substituted aromatic compounds for use in prevention or treatment of various fibrotic diseases and conditions in subjects, including pulmonary fibrosis, liver fibrosis, skin fibrosis and cardiac fibrosis, where the compound has the following formula: or a pharmaceutically acceptable salt thereof, wherein A is C5 alkyl, C6 alkyl, C5 alkenyl, C6 alkenyl, C(O)-(CH2)n-CH3 or CH(OH)-(CH2)n-CH3 wherein n is 3 or 4; R1 is H, OH or F; R2 is H, OH, F or CH2-OH; R3 is H, OH, F or CH2Ph; R4 is H, OH or F; Q is 1 ) (CH2)mC(O)OH wherein m is 1 or 2, 2) CH(CH3)C(O)OH, 3) C(CH3)2C(O)OH, 4) CH(F)-C(O)OH, 5) CF2-C(O)OH, or 6) C(O)-C(O)OH.

  本发明涉及用于预防或治疗主体中的各种纤维化疾病和状况，包括肺纤维化、肝纤维化、皮肤纤维化和心脏纤维化的取代芳香族化合物，其中化合物具有以下公式：或其药学上可接受的盐，其中A为C5烷基，C6烷基，C5烯基，C6烯基，C（O）-（CH2）n-CH3或CH（OH）-（ ）n- ，其中n为3或4；R1为H，OH或F；R2为H，OH，F或 -OH；R3为H，OH，F或 Ph；R4为H，OH或F；Q为1）（ ）mC（O）OH，其中m为1或2，2）CH（ ）C（O）OH，3）C（ ）2C（O）OH，4）CH（F）-C（O）OH，5）CF2-C（O）OH或6）C（O）-C（O）OH。
• SUBSTITUTED AROMATIC COMPOUNDS FOR THE TREATMENT OF PULMONARY FIBROSIS, LIVER FIBROSIS,SKIN FIBROSIS AND CARDIAC FIBROSIS
  申请人：PROMETIC BIOSCIENCES INC.

  公开号：US20160023983A1

  公开（公告）日：2016-01-28

  The present invention relates to substituted aromatic compounds for use in prevention or treatment of various fibrotic diseases and conditions in subjects, including pulmonary fibrosis, liver fibrosis, skin fibrosis and cardiac fibrosis, where the compound has the following formula: or a pharmaceutically acceptable salt thereof, wherein A is C 5 alkyl, C 6 alkyl, C 5 alkenyl, C 6 alkenyl, C(O)—(CH 2 ) n —CH 3 or CH(OH)—(CH 2 ) n —CH 3 wherein n is 3 or 4; R 1 is H, OH or F; R 2 is H, OH, F or CH 2 —OH; R 3 is H, OH, F or CH 2 Ph; R 4 is H, OH or F; Q is 1) (CH 2 ) m C(O)OH wherein m is 1 or 2, 2) CH(CH 3 )C(O)OH, 3) C(CH 3 ) 2 C(O)OH, 4) CH(F)—C(O)OH, 5) CF 2 —C(O)OH, or 6) C(O)—C(O)OH.

  本发明涉及用于预防或治疗受体内各种纤维化疾病和情况的取代芳香族化合物，包括肺纤维化，肝纤维化，皮肤纤维化和心脏纤维化，其中该化合物具有以下公式：或其药学上可接受的盐，其中A是C5烷基，C6烷基，C5烯基，C6烯基，C（O）-（CH2）n-CH3或CH（OH）-（ ）n- ，其中n为3或4；R1为H，OH或F；R2为H，OH，F或 -OH；R3为H，OH，F或 Ph；R4为H，OH或F；Q为1）（ ）mC（O）OH，其中m为1或2，2）CH（ ）C（O）OH，3）C（ ）2C（O）OH，4）CH（F）-C（O）OH，5）CF2-C（O）OH或6）C（O）-C（O）OH。
• Substituted aromatic compounds and pharmaceutical compositions for tissue self-repair and regeneration
  申请人：PROMETIC PHARMA SMT LIMITED

  公开号：US10391073B2

  公开（公告）日：2019-08-27

  Described herein are compounds of Formula I, or pharmaceutically acceptable salts thereof, or combinations thereof, as well as uses thereof. Such uses include promoting tissue self-repair or tissue regeneration of an organ, stimulating the generation of tissue growth, modulating (e.g. increasing) the level of a tissue-repair marker, treating physical injury in an organ, tissue, or cell, promoting wound healing as well as anti-aging applications. Corresponding compositions, methods and uses are also described. Formula I wherein A is C5 alkyl, C6 alkyl, C5 alkenyl, C6 alkenyl, C(O)—(CH2)n—CH3 or CH(OH)—(CH2)n—CH3 wherein n is 3 or 4; R1 is H, F of OH; R2 is H, F, OH, C5 alkyl, C6 alkyl, C5 alkenyl, C6 alkenyl, C(O)—(CH2)n—CH3 or CH(OH)—(CH2)n—CH3 wherein n is 3 or 4; R3 is H, F, OH, or CH2Ph; R4 is H, F or OH; Q is 1) (CH2),C(O)OH wherein m is 1 or 2 2) CH(CH3)C(O)OH, 3) C(CH3)2C(O)OH, 4) CH(F)—C(O)OH, 5) CF2—C(O)OH or 6) C(O)—C(O)OH.

  本文描述的是式 I 化合物或其药学上可接受的盐或其组合物及其用途。这些用途包括促进组织自我修复或器官的组织再生，刺激组织生长，调节（如增加）组织修复标记物的水平，治疗器官、组织或细胞的物理损伤，促进伤口愈合以及抗衰老应用。还描述了相应的组合物、方法和用途。式 I 其中 A 是 C5 烷基、C6 烷基、C5 烯基、C6 烯基、C(O)-(CH2)n-CH3 或 CH(OH)-( )n- ，其中 n 是 3 或 4；R1 是 H、F 或 OH；R2 是 H、F、OH、C5 烷基、C6 烷基、C5 烯基、C6 烯基、C(O)-( )n- 或 CH(OH)-( )n- ，其中 n 是 3 或 4；R3 是 H、F、OH 或 Ph；R4 是 H、F 或 OH；Q 是 1) ( ),C(O)OH，其中 m 是 1 或 2 2) CH( )C(O)OH，3) C( )2C(O)OH，4) CH(F)-C(O)OH，5) CF2-C(O)OH 或 6) C(O)-C(O)OH。