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碘氟潘 | 155798-07-5

中文名称
碘氟潘
中文别名
——
英文名称
[123I]-2β-carbomethoxy-3β-(4-iodophenyl)-N-(3-fluoropropyl)nortropane
英文别名
(1R,2S,3S,5S)-methyl 8-(3-fluoropropyl)-3-(4-[123l]iodophenyl)-8-azabicyclo[3.2.1]octane-2-carboxylate;[123I]-FP-CIT;[123I]-DaTSCAN;Ioflupane I-123;methyl (1R,2S,3S,5S)-8-(3-fluoropropyl)-3-(4-(123I)iodanylphenyl)-8-azabicyclo[3.2.1]octane-2-carboxylate
碘氟潘化学式
CAS
155798-07-5
化学式
C18H23FINO2
mdl
——
分子量
427.385
InChiKey
HXWLAJVUJSVENX-HFIFKADTSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

物化性质

  • 熔点:
    82-83°
  • 比旋光度:
    D24 -12.8°
  • 溶解度:
    Soluble in water

计算性质

  • 辛醇/水分配系数(LogP):
    4
  • 重原子数:
    23
  • 可旋转键数:
    6
  • 环数:
    3.0
  • sp3杂化的碳原子比例:
    0.61
  • 拓扑面积:
    29.5
  • 氢给体数:
    0
  • 氢受体数:
    4

ADMET

毒理性
  • 在妊娠和哺乳期间的影响
◉ 母乳喂养期间使用总结:本记录中的信息是指将碘氟潘I 123作为诊断剂的使用。核医学协会建议在给予碘氟潘I 123示踪剂后至少中断母乳喂养1天,可能长达6天;制造商表示,在给予哺乳母亲碘氟潘I 123后,应中断母乳喂养6天。然而,这段时间是基于I 123被其他碘同位素污染的假设,这种情况已不再存在。可能适当缩短这段时间。在中断期间,应定期且完全排空乳房。如果母亲在检查前已经挤出并保存了乳汁,她可以在哺乳中断期间用这些乳汁喂养婴儿。母亲在哺乳中断期间泵出的乳汁可以丢弃,或者冷藏保存,并在泵奶后经过10个物理半衰期,大约5.5天后,给予婴儿。 担心乳汁中放射性水平的母亲可以要求在医院核医学科进行检测。当放射性水平达到安全水平时,她可以恢复母乳喂养。已经发布了一种测量乳汁放射性并确定母亲可以安全恢复母乳喂养的时间的方法。 ◉ 对哺乳婴儿的影响:截至修订日期,没有找到相关的已发布信息。 ◉ 对泌乳和母乳的影响:截至修订日期,没有找到相关的已发布信息。
◉ Summary of Use during Lactation:Information in this record refers to the use of ioflupane I 123 as a diagnostic agent. The Society of Nuclear Medicine recommends that breastfeeding be interrupted for at least 1 day and possibly up to 6 days following tracer doses of ioflupane I 123; the manufacturer states that breastfeeding should be interrupted for 6 days after administration of ioflupane I 123 to a nursing mother. However, this time period is based on the presumption that I 123 is contaminated with other iodine isotopes, which is no longer the case. A shorter time might be appropriate. During the period of interruption, the breasts should be emptied regularly and completely. If the mother has expressed and saved milk prior to the examination, she can feed it to the infant during the period of nursing interruption. The milk that is pumped by the mother during the time of breastfeeding interruption can either be discarded or stored refrigerated and given to the infant after 10 physical half-lives, or about 5.5 days, have elapsed since pumping. Mothers concerned about the level of radioactivity in their milk could ask to have it tested at a nuclear medicine facility at their hospital. When the radioactivity is at a safe level, she may resume breastfeeding. A method for measuring milk radioactivity and determining the time when a mother can safely resume breastfeeding has been published. ◉ Effects in Breastfed Infants:Relevant published information was not found as of the revision date. ◉ Effects on Lactation and Breastmilk:Relevant published information was not found as of the revision date.
来源:Drugs and Lactation Database (LactMed)
吸收、分配和排泄
  • 吸收
因为是通过静脉注射给药,所以吸收率为100%。
Absorption is 100% because administered I.V.
来源:DrugBank
吸收、分配和排泄
  • 消除途径
大约60%通过尿液排出,14%通过粪便排出,这个过程需要48小时。
About 60% is excreted in the urine and 14% in the feces after 48 hours.
来源:DrugBank
吸收、分配和排泄
  • 分布容积
与整个大脑相比,大约30%的放射性物质被纹状体吸收。
Compared to the entire brain, about 30% of radioactivity is taken up by the striatum.
来源:DrugBank

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为产物:
    参考文献:
    名称:
    [EN] METHOD FOR THE PREPARATION OF N-MONOFLUOROALKYL TROPANES AND THEIR USE
    [FR] PROCÉDÉ DE PRÉPARATION DE N-MONOFLUOROALKYL-TROPANES ET LEUR UTILISATION
    摘要:
    本发明涉及一种制备N-单氟烷基曲巴克碱的方法,一种制备三烷基锡曲巴克碱的方法,一种制备碘化和/或放射碘化曲巴克碱的方法,以及将N-单氟烷基曲巴克碱用作三烷基锡曲巴克碱和/或碘化和/或放射碘化曲巴克碱制备方法中的前体的用途。
    公开号:
    WO2021148598A1
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文献信息

  • IMAGING AGENTS
    申请人:Drummond Margaret Struthers
    公开号:US20140010762A1
    公开(公告)日:2014-01-09
    An imaging agent for cells which produces an intracellular imaging signal proportional to the amount of hCE-1 in the cells independently of the amount of hCE-2 and/or hCE-3 in the cells, said imaging agent being a covalent conjugate of (a) an imaging agent and (b) an alpha mono- or di-substituted amino acid ester, wherein (a) is directly linked to (b), or (a) is indirectly linked to (b) by a linker radical, and wherein said direct or indirect linkage is via the amino group of (b), and wherein the amino group is not directly linked to a carbonyl group, and wherein the said alpha mono- or di-substituted amino acid ester part is selectively hydrolysable to the corresponding carboxylic acid part by the intracellular carboxylesterase enzyme hCE-1 relative to the intracellular enzymes hCE-2 or hCE-3.
    一种细胞成像剂,其产生与细胞中hCE-1数量成比例的胞内成像信号,而与细胞中hCE-2和/或hCE-3的数量无关,所述成像剂是(a)成像剂和(b)α-单或双取代氨基酸酯的共价结合物,其中(a)直接与(b)连接,或者(a)通过链连接基间接与(b)连接,且所述直接或间接连接是通过(b)的氨基团,且所述氨基团不直接连接到羰基团,所述α-单或双取代氨基酸酯部分可被细胞内羧酸酯酶酶hCE-1选择性水解为相应的羧酸部分,而相对于细胞内酶hCE-2或hCE-3而言。
  • [EN] METHOD FOR THE PREPARATION OF N-MONOFLUOROALKYL TROPANES AND THEIR USE<br/>[FR] PROCÉDÉ DE PRÉPARATION DE N-MONOFLUOROALKYL-TROPANES ET LEUR UTILISATION
    申请人:ROTOP RADIOPHARMACY GMBH
    公开号:WO2021148598A1
    公开(公告)日:2021-07-29
    The present invention relates to a method for the preparation of an N-monofluoroalkyl tropane, a method for the preparation of a trialkyltin tropane, a method for the preparation of an iodinated and/or radioiodinated tropane and the use of the N-monofluoroalkyl tropane as a precursor in the method for the preparation of the trialkyltin tropane and/or the iodinated and/or radioiodinated tropane.
    本发明涉及一种制备N-单氟烷基曲巴克碱的方法,一种制备三烷基锡曲巴克碱的方法,一种制备碘化和/或放射碘化曲巴克碱的方法,以及将N-单氟烷基曲巴克碱用作三烷基锡曲巴克碱和/或碘化和/或放射碘化曲巴克碱制备方法中的前体的用途。
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