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9-bromo-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(12),3,8-triene-10,11-dione

中文名称
——
中文别名
——
英文名称
9-bromo-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(12),3,8-triene-10,11-dione
英文别名
——
9-bromo-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(12),3,8-triene-10,11-dione化学式
CAS
——
化学式
C10H7BrN2O2
mdl
——
分子量
267.08
InChiKey
FDGKQWLSJXEOPF-UHFFFAOYSA-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

计算性质

  • 辛醇/水分配系数(LogP):
    1.2
  • 重原子数:
    15
  • 可旋转键数:
    0
  • 环数:
    3.0
  • sp3杂化的碳原子比例:
    0.2
  • 拓扑面积:
    62
  • 氢给体数:
    2
  • 氢受体数:
    3

文献信息

  • Method to Use Compositions Having Antidepressant Anxiolytic and Other Neurological Activity and Compositions of Matter
    申请人:Hamann Mark T.
    公开号:US20090093513A1
    公开(公告)日:2009-04-09
    The sponges were collected from a variety of locations in the Florida Keys and separated based on morphology and color. The samples were identified as three species, two of which are well known: V. rigida (Esper, 1794) (order Verongida, family Aplysinidae) and S. aurea (Hyatt, 1875) (order Dictyoceratida, family Thorectidae), and a third S. cerebriformis (Duchassaing & Michelotti, 1864), is less common and separated based on subtle differences of morphology and coloration, from the other two species. Several compounds were isolated and were evaluated in established animal models predictive of neurological related drug function, namely, the rodent FST and the chick anxiety-depression model.
    海绵从佛罗里达群岛的多个地点收集,并根据形态和颜色进行分离。样本被鉴定为三个物种,其中两个是众所周知的:V. rigida(Esper, 1794)(Verongida目,Aplysinidae科)和S. aurea(Hyatt, 1875)(Dictyoceratida目,Thorectidae科),第三个S. cerebriformis(Duchassaing & Michelotti, 1864)较为罕见,根据形态和颜色的微小差异分离出来。多种化合物被分离出来,并在已建立的动物模型中进行评估,这些模型可预测与神经相关的药物作用,即啮齿动物FST和小鸡焦虑-抑郁模型。
  • METHOD TO USE COMPOSITIONS HAVING ANTIDEPRESSANT ANXIOLYTIC AND OTHER NEUROLOGICAL ACTIVITY AND COMPOSITIONS OF MATTER
    申请人:Triton Biopharma, Llc
    公开号:EP2209380A1
    公开(公告)日:2010-07-28
  • US8268856B2
    申请人:——
    公开号:US8268856B2
    公开(公告)日:2012-09-18
  • [EN] METHOD TO USE COMPOSITIONS HAVING ANTIDEPRESSANT ANXIOLYTIC AND OTHER NEUROLOGICAL ACTIVITY AND COMPOSITIONS OF MATTER<br/>[FR] PROCÉDÉ D'UTILISATION DE COMPOSITIONS AYANT UNE ACTIVITÉ ANXIOLYTIQUE ET ANTIDÉPRESSIVE, AINSI QUE NEUROLOGIQUE AUTRE ET COMPOSITIONS DE MATIÈRE
    申请人:TRITON BIOPHARMA LLC
    公开号:WO2009049030A1
    公开(公告)日:2009-04-16
    The sponges were collected from a variety of locations in the Florida Keys and separated based on morphology and color. The samples were identified as three species, two of which are well known: V. rigida (Esper, 1794) (order Verongida, family Aplysinidae) and S. aurea (Hyatt, 1875) (order Dictyoceratida, family Thorectidae), and a third S. cerebriformis (Duchassaing & Michelotti, 1864), is less common and separated based on subtle differences of morphology and coloration, from the other two species. Several known compounds were isolated and those that bear structural similarity to serotonin were evaluated in two established animal models predictive of antidepressant drug action, namely, the rodent FST and the chick anxiety-depression model.
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表征谱图

  • 氢谱
    1HNMR
  • 质谱
    MS
  • 碳谱
    13CNMR
  • 红外
    IR
  • 拉曼
    Raman
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cnmr
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  • 峰位数据
  • 峰位匹配
  • 表征信息
Shift(ppm)
Intensity
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Assign
Shift(ppm)
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测试频率
样品用量
溶剂
溶剂用量
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