CAS: 62687-22-3; 6,6'-Dihydroxy-6,6',9,9'-Tetramethyl-3'-Methylene-2,2'-Dioxo-2',3A,3',3A',4,5,5',6,6A,6',7,9A,9B,9',9A',9B'-Hexadecahydro-4'H-Spiro[azuleno[4,5-B]Furan-3,10'-[6A,9]Ethanoazuleno[4,5-B]Furan]-4-Yl Acetate

该化合物是一个复杂的有机化合物,其特点是分子结构复杂,包括多个手性中心和功能组;该物质具有环环框架,表明其独特的立体化学和潜在的生物活动;氢氧基组的存在表明,它可能具有氢联结能力,影响其溶性与再活性;乙酸盐表明有产生蒸发反应的潜力,而二氧化物组则可能促进其在各种化学环境中的回活动;总体而言,该化合物的结构复杂性可能导致有趣的药理学特性,使其成为医学化学和相关领域进一步研究的候选物.

英文名称6,6'-Dihydroxy-6,6',9,9'-Tetramethyl-3'-Methylene-2,2'-Dioxo-2',3A,3',3A',4,5,5',6,6A,6',7,9A,9B,9',9A',9B'-Hexadecahydro-4'H-Spiro[azuleno[4,5-B]Furan-3,10'-[6A,9]Ethanoazuleno[4,5-B]Furan]-4-Yl Acetate
中文名称野菊花内酯
IUPAC名称6,6'-dihydroxy-6,6',9,9'-tetramethyl-3'-methylene-2,2'-dioxo-2',3a,3',3a',4,5,5',6,6a,6',7,9a,9b,9',9a',9b'-hexadecahydro-4'H-spiro[azuleno[4,5-b]furan-3,10'-[6a,9]ethanoazuleno[4,5-b]furan]-4-yl acetate
其它别名Handelin; Yejuhualactone; Handelin; Yejuhualactone; 6,6'-Dihydroxy-6,6',9,9'-Tetramethyl-3'-Methylene-2,2'-Dioxo-2',3A,3',3A',4,5,5',6,6A,6',7,9A,9B,9',9A',9B'-Hexadecahydro-4'H-Spiro[azuleno[4,5-B]Furan-3,10'-[6A,9]Ethanoazuleno[4,5-B]Furan]-5-Yl Acetate; Spiro[azuleno[4,5-B]Furan-3(2H),10'-[4H-6A,9]Ethanoazuleno[4,5-B]Furan]-2,2'(3'H)-Dione, 4-(Acetyloxy)-3A,3'A,4,5,5',6,6',6A,7,9',9A,9'A,9B,9'B-Tetradecahydro-6,6'-Dihydroxy-6,6',9,9'-Tetramethyl-3'-Methylene-, (3R,3Ar,3'As,4S,6R,6'R,6Ar,6'Ar,9'R,9Ar,9'As,9Br,9'Bs)-; Handelin, 10 Mm In Dmso
CAS编号62687-22-3
MFCD编号:MFCD11656142
分子式:C32H40O8
分子量:552.66
产品CID: 1608214
产品分类生物化工 → 植物提取物

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产品信息参考
InChIKey: DSNIKOZTDZBWKD-XMNJDQQWSA-N
SZQWAXGDCUONOB-GZFIRXSHNA-N…
计算化学: 氢键受体数8.0氢键供体数2.0可旋转键数2.0

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主要参考文献

1: Wang LC, Liao LX, Lv HN, Liu D, Dong W, Zhu J, Chen JF, Shi ML, Fu G, Song XM, Jiang Y, Zeng KW, Tu PF. Highly Selective Activation of Heat Shock Protein 70 by Allosteric Regulation Provides an Insight into Efficient Neuroinflammation Inhibition. EBioMedicine. 2017 Sep;23:160-172. doi: 10.1016/j.ebiom.2017.08.011. Epub 2017 Aug 9.
2: Pyee Y, Chung HJ, Choi TJ, Park HJ, Hong JY, Kim JS, Kang SS, Lee SK. Suppression of inflammatory responses by handelin, a guaianolide dimer from Chrysanthemum boreale, via downregulation of NF-κB signaling and pro-inflammatory cytokine production. J Nat Prod. 2014 Apr 25;77(4):917-24. doi: 10.1021/np4009877. Epub 2014 Apr 1.
6: Patrizio P, Asch RH, Handelin B, Silber SJ. Aetiology of congenital absence of vas deferens: genetic study of three generations. Hum Reprod. 1993 Feb;8(2):215-20.

合成参考文献

参考文献:10.5281/zenodo.5794106
摘要:The LOTUS Initiative for Open Natural Products Research: frozen dataset union wikidata (with metadata) | DOI:10.5281/zenodo.5794106
参考文献:10.1016/j.ebiom.2017.08.011
摘要:Wang LC, Liao LX, Lv HN, Liu D, Dong W, Zhu J, Chen JF, Shi ML, Fu G, Song XM, Jiang Y, Zeng KW, Tu PF. Highly Selective Activation of Heat Shock Protein 70 by Allosteric Regulation Provides an Insight into Efficient Neuroinflammation Inhibition. EBioMedicine. 2017 Sep;23():160–72.