salvinorin A-7-hemisuccinate | 865438-42-2

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: salvinorin A-7-hemisuccinate
• 英文别名: hapten A；4-[[(2S,4aR,6aR,7R,9S,10aS,10bR)-2-(furan-3-yl)-7-methoxycarbonyl-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromen-9-yl]oxy]-4-oxobutanoic acid
• CAS: 865438-42-2
• 化学式: C₂₅H₃₀O₁₀
• 分子量: 490.507
• InChiKey: GDKYEAHWIITRPH-BNSSAQQSSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  35
• 可旋转键数：
  8
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.64
• 拓扑面积：
  146
• 氢给体数：
  1
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  丹酚 A 在 4-二甲氨基吡啶 、 sodium carbonate 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 反应 52.0h， 生成 salvinorin A-7-hemisuccinate
  参考文献：
  名称：

  Development of an Enzyme Immunoassay Using a Monoclonal Antibody against the Psychoactive Diterpenoid Salvinorin A

  摘要：

  Salvinorin A (1), the main active constituent in Salvia divinorum, is a highly selective kappa-opioid receptor agonist with hallucinogenic effects, which is regulated in several countries. In the present study, a monoclonal antibody (mAb) against 1 was prepared, and an indirect competitive enzyme-linked immunosorbent assay (icELISA) system was developed for the detection of salvinorins. To raise mAbs against 1, salvinorin B (2) hemisuccinate was synthesized and used to prepare the immunogen 2-bovine serum albumin conjugate. This technique was used to prepare a hybridoma cell line, 3D5, which secreted a rnAb that recognized 1. The mAb was shown to have specificity for 1 and other salvinorins in cross-reactivity tests. The intra-assay calibration range by icELISA using the mAb against 1 was 0.0195-0.625 mu g/mL. After validating the icELISA using intra- and interassays, a recovery experiment and analysis of several plants in the family Lamiaceae, including S. divinorum, confirmed that the analytical method based on ELISA is not only simple but also precise, accurate, sensitive, and sufficiently reliable. The results indicate that icELISA is a useful tool in the identification of S. divinorum.

  DOI：

  10.1021/np400358n

文献信息

• Salvinorin immunoassay
  申请人：Fitzgerald Stephen P.

  公开号：US09222949B2

  公开（公告）日：2015-12-29

  The present invention provides an immunoassay method for detecting or determining the amount of salvinorin A, salvinorin B and/or analogues thereof in an in vitro sample, an antibody for salvinorin A, salvinorin B and/or analogues thereof and a kit for detecting the presence of or determining the amount of salvinorin A, salvinorin B and its analogues thereof in a sample.

  本发明提供了一种用于检测或测定体外样品中salvinorin A、salvinorin B和/或其类似物的数量的免疫测定方法，一种用于salvinorin A、salvinorin B和/或其类似物的抗体，以及一种用于检测样品中salvinorin A、salvinorin B及其类似物存在或测定其数量的试剂盒。
• Immunoassay
  申请人：Fitzgerald Stephen P.

  公开号：US20100291600A1

  公开（公告）日：2010-11-18

  The present invention provides an immunoassay method for detecting or determining the amount of salvinorin A, salvinorin B and/or analogues thereof in an in vitro sample, an antibody for salvinorin A, salvinorin B and/or analogues thereof and a kit for detecting the presence of or determining the amount of salvinorin A, salvinorin B and its analogues thereof in a sample.

  本发明提供了一种免疫测定方法，用于检测或确定体外样品中沙维诺林A、沙维诺林B和/或其类似物的数量，一种用于沙维诺林A、沙维诺林B和/或其类似物的抗体，以及一种用于检测样品中沙维诺林A、沙维诺林B及其类似物的存在或确定其数量的试剂盒。
• Kappa-opioid receptor-selective dicarboxylic ester-derived salvinorin A ligands
  作者：Prabhakar R. Polepally、Kate White、Eyal Vardy、Bryan L. Roth、Daneel Ferreira、Jordan K. Zjawiony

  DOI：10.1016/j.bmcl.2013.03.111

  日期：2013.5

  Salvinorin A, the active ingredient of the hallucinogenic plant Salvia divinorum is the most potent known naturally occurring hallucinogen and is a selective kappa-opioid receptor agonist. To better understand the ligand-receptor interactions, a series of dicarboxylic ester-type of salvinorin A derivatives were synthesized and evaluated for their binding affinity at kappa-, delta- and mu-opioid receptors. Most of the analogues show high affinity to the kappa-opioid receptor. Methyl malonyl derivative 4 shows the highest binding affinity (K-i = 2 nM), analogues 5, 7, and 14 exhibit significant affinity for the kappa-receptor (K-i = 21, 36 and 39 nM). (C) 2013 Elsevier Ltd. All rights reserved.
• US9222949B2
  申请人：——

  公开号：US9222949B2

  公开（公告）日：2015-12-29
• Development of an Enzyme Immunoassay Using a Monoclonal Antibody against the Psychoactive Diterpenoid Salvinorin A
  作者：Madan Kumar Paudel、Osamu Shirota、Kaori Sasaki-Tabata、Hiroyuki Tanaka、Setsuko Sekita、Satoshi Morimoto

  DOI：10.1021/np400358n

  日期：2013.9.27

  Salvinorin A (1), the main active constituent in Salvia divinorum, is a highly selective kappa-opioid receptor agonist with hallucinogenic effects, which is regulated in several countries. In the present study, a monoclonal antibody (mAb) against 1 was prepared, and an indirect competitive enzyme-linked immunosorbent assay (icELISA) system was developed for the detection of salvinorins. To raise mAbs against 1, salvinorin B (2) hemisuccinate was synthesized and used to prepare the immunogen 2-bovine serum albumin conjugate. This technique was used to prepare a hybridoma cell line, 3D5, which secreted a rnAb that recognized 1. The mAb was shown to have specificity for 1 and other salvinorins in cross-reactivity tests. The intra-assay calibration range by icELISA using the mAb against 1 was 0.0195-0.625 mu g/mL. After validating the icELISA using intra- and interassays, a recovery experiment and analysis of several plants in the family Lamiaceae, including S. divinorum, confirmed that the analytical method based on ELISA is not only simple but also precise, accurate, sensitive, and sufficiently reliable. The results indicate that icELISA is a useful tool in the identification of S. divinorum.