3β,5α-Bisphenylthiocholestane | 124325-07-1

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 类固醇和类固醇衍生物
• 英文名称: 3β,5α-Bisphenylthiocholestane
• 英文别名: 3β.5-diphenylsulfanyl-5α-cholestane；3β.5-Diphenylmercapto-10.13-dimethyl-17β-((R)-1.5-dimethyl-hexyl)-5α-gonan；(10R)-3c.5t-Diphenylmercapto-10r.13c-dimethyl-17c-((R)-1.5-dimethyl-hexyl)-(8cH.9tH.14tH)-hexadecahydro-1H-cyclopenta[a]phenanthren；3β.5-Diphenylmercapto-5α-cholestan；(3S,5R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-3,5-bis(phenylsulfanyl)-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene
• CAS: 124325-07-1
• 化学式: C₃₉H₅₆S₂
• 分子量: 589.006
• InChiKey: FOZXGVJZUDRVOL-QRYRTAGCSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13.7
• 重原子数：
  41
• 可旋转键数：
  9
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  50.6
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  cholesteryl acetate 、 苯硫酚 在 三氟化硼乙醚 作用下， 以 二氯甲烷 为溶剂， 反应 24.0h， 以0.1 g的产率得到3β,5α-Bisphenylthiocholestane
  参考文献：
  名称：

  Transformed steroids 176. Reaction of ?5-3?-substituted 16?,17?-cyclohexanopregnen-20-ones with thiols: synthesis of 3-mono- and 3,5-bis-sulfur-containing steroids

  摘要：

  DOI：

  10.1007/bf00957162

文献信息

• Some Reactions of Cholesteryl p-Toluenesulfonate¹
  作者：Herbert McKennis

  DOI：10.1021/ja01182a072

  日期：1948.2
• LEVINA, I. S.;KULIKOVA, L. E.;CHEREPANOVA, E. G.;BOGDANOV, V. S., IZV. AN CCCP. CEP. XIM.,(1989) N, S. 1364-1369
  作者：LEVINA, I. S.、KULIKOVA, L. E.、CHEREPANOVA, E. G.、BOGDANOV, V. S.

  DOI：——

  日期：——
• Assessment of the Effects of Sugar Cane Plantation Burning on Daily Counts of Inhalation Therapy
  作者：Marcos A. Arbex、Gyorgy M. Böhm、Paulo H.N. Saldiva、Gleice M.S. Conceição、Arden C. Pope III、Alfesio L.F. Braga

  DOI：10.1080/10473289.2000.10464211

  日期：2000.10

  This study was designed to evaluate the association between sugar cane plantation burning and hospital visits in Araraquara in the state of Sao Paulo, Brazil. From June 1 to August 31, 1995, the daily number of visits of patients who needed inhalation therapy in one of the main hospitals of the city was recorded and used as health impairment estimation. Sedimentation of particle mass (the amount of particles deposited on four containers filled with water) was measured daily. The association between the weight of the sediment and the number of visits was evaluated by means of Poisson regression models controlled for seasonality, temperature, day of the week, and rain. We found a significant and dose-dependent relationship between the number of visits and the amount of sediment. The relative risk of visit associated with an increase of 10 mg in the sediment weight was 1.09 (1-1.19), and the relative risk of an inhalation therapy was 1.20 (1.03-1.39) on the most polluted days (fourth quartile of sediment mass). These results indicate that sugar cane burning may cause deleterious health effects in the exposed population.