6-乙酰氧基射干酚B | 1388841-30-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚酯
• 中文名称: 6-乙酰氧基射干酚B
• 英文名称: (Z)-4-hydroxy-2-methoxy-6-(pentadec-10-en-1-yl)phenyl acetate
• 英文别名: 1-O-methyl-6-acetoxy-5-(pentadec-10Z-enyl)resorcinol；6-Acetoxy Belamcandol B；[4-hydroxy-2-methoxy-6-[(Z)-pentadec-10-enyl]phenyl] acetate
• CAS: 1388841-30-2
• 化学式: C₂₄H₃₈O₄
• 分子量: 390.563
• InChiKey: SEHINANGVRSSGQ-FPLPWBNLSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.2
• 重原子数：
  28
• 可旋转键数：
  16
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  55.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  6-乙酰氧基射干酚B 在 吡啶 、 二甲基硫 、 臭氧 作用下， 以 二氯甲烷 为溶剂， 反应 18.0h， 生成
  参考文献：
  名称：

  Alkenylresorcinols and cytotoxic activity of the constituents isolated from Labisia pumila

  摘要：

  Phytochemical investigation on the leaves of Labisia pumila (Myrsinaceae), an important medicinal herb in Malaysia, has led to the isolation of 1-O-methyl-6-acetoxy-5-(pentadec-10Z-enyl)resorcinol (1), labisiaquinone A (2) and labisiaquinone B (3). Along with these, 16 known compounds including 1-O-methyl-6-acetoxy-5-pentadecylresorcinol (4), 5-(pentadec-10Z-enyl)resorcinol (5), 5-(pentadecyl)resorcinol (6), (-)-loliolide (7), stigmasterol (8), 4-hydroxyphenylethylamine (9), 3,4,5-trihydroxybenzoic acid (10), 3,4-dihydroxybenzoic acid (11), (+)-catechin (12), (-)-epicatechin (13), kaempferol-3-O-alpha-rhamnopyranosyl-7-O-beta-glycopyranoside (14), kaempferol-4'-O-beta-glycopyranoside (15), quercetin-3-O-alpha-rhamnopyranoside (16), kaempferol-3-O-alpha-rhamnopyranoside (17), (9Z,12Z)-octadeca-9,12-dienoic acid (18) and stigmasterol-3-O-beta-glycopyranoside (19) were also isolated. The structures of these compounds were established on the basis of 1D and 2D NMR spectroscopy techniques (H-1, C-13, COSY, HSQC, NOESY and HMBC experiments), mass spectrometry and chemical derivatization. Among the constituents tested 1 and 4 exhibited strongest cytotoxic activity against the PC3, HCT116 and MCF-7 cell lines (IC50 values <= 10 mu M), and they showed selectivity towards the first two-cell lines relative to the last one. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.phytochem.2012.04.008

文献信息

• [EN] USE OF CERTAIN TRIOXYGENATED BENZENE DERIVATIVES IN BODY FAT MANAGEMENT<br/>[FR] UTILISATION DE CERTAINS DÉRIVÉS DE BENZÈNE TRIOXIGÉNÉ DANS LA GESTION DE GRAISSE CORPORELLE
  申请人：BIOTROPICS MALAYSIA BERHAD

  公开号：WO2013112040A1

  公开（公告）日：2013-08-01

  The invention primarily relates to the use of certain trioxygenated benzene derivatives of formula (I) or a corresponding plant extract as body fat modulating agents, preferably as anti-cellulite actives and/or for the reduction of the body fat content, in particular for reduction of body weight and/or for the management of obesity. The present invention also relates to corresponding methods and to certain novel compounds of formula (I). The invention further relates to specific plant extract formulations obtainable from a plant of the family Myrsinaceae, preferably from the genus Labisia, and to compositions, in particular cosmetic or pharmaceutical formulations, comprising an effective amount of one or more compounds of formula (I) or of a corresponding plant extract formulation.