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α-tocopherol

中文名称
——
中文别名
——
英文名称
α-tocopherol
英文别名
5,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-ol
α-tocopherol化学式
CAS
——
化学式
C28H48O2
mdl
——
分子量
416.688
InChiKey
WCLCXQXLAQYYQC-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):
    10.5
  • 重原子数:
    30
  • 可旋转键数:
    12
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.79
  • 拓扑面积:
    29.5
  • 氢给体数:
    1
  • 氢受体数:
    2

反应信息

  • 作为反应物:
    描述:
    6-mercaptopurineα-tocopherol四氢呋喃 为溶剂, 生成 、 α-tocopheroxy radical
    参考文献:
    名称:
    Photochemical Properties of Excited Triplet State of 6H-Purine-6-thione Investigated by Laser Flash Photolysis
    摘要:
    Photochemical reactions of 6H-purine-6-thione (PuT) via the excited triplet state [(3)(PuT)*] have been studied by means of laser flash photolysis in organic solvents. Transient absorption bands at 475 and 690 nm were assigned to (3)(PuT)*. Intersystem quantum yield and the lowest triplet energy of (3)(PuT)* were evaluated to be 0.99 and 63 kcal/mol, respectively. The self-quenching rate constant is quite large (2.3 x 10(9) M-1 s(-1) in THF). In photoinduced electron transfer, (3)(PuT)* acts as electron acceptor for tetramethylbenzidine, while (3)(PuT)* acts as electron donor for p-dinitrobenzene. Rate constants for H-atom abstraction (k(hT)) Of (3)(PUT)* from benzenethiols, tocopherol, and 1,4-cyclohexadiene are on the order of 10(8) M-1 s(-1). From the Hammett plots of k(hT) for substituted benzenethiols, a negative rho value indicates that (3)(PuT)* has electrophilic character. In the addition reaction of (3)(PuT)* toward various alkenes, the electrophilic character of (3)(PuT)* was also confirmed. By steady-light photolysis of PuT, purine was produced via (3)(PuT)* after H-atom abstraction. On combination of these results, the character of the lowest (3)(PuT)* was presumed.
    DOI:
    10.1021/jp973274q
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文献信息

  • Method of vitamin production
    申请人:DCV Inc. doing business as Bio-Technical Resourses
    公开号:EP2305825A1
    公开(公告)日:2011-04-06
    The invention relates to methods for producing farnesol or geranylgeraniol comprising: (a) culturing a microorganism in a fermentation medium to produce a product selected from the group consisting of farnesyl phosphate and farnesol or geranylgeranyl phosphate and geranylgeraniol, wherein the action of squalene synthase of said microorganism is reduced; and (b) recovering said product.
    本发明涉及生产法呢醇香叶基香叶醇的方法,包括:(a) 在发酵培养基中培养微生物,生产选自磷酸法呢醇法呢醇磷酸香叶基香叶醇香叶基香叶醇的产物,其中所述微生物角鲨烯合成酶的作用减弱;以及 (b) 回收所述产物。
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