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2-[(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)methyl]-5,5-dimethyl-1,3-cyclohexanedione

中文名称
——
中文别名
——
英文名称
2-[(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)methyl]-5,5-dimethyl-1,3-cyclohexanedione
英文别名
2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione
2-[(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)methyl]-5,5-dimethyl-1,3-cyclohexanedione化学式
CAS
——
化学式
C17H24O4
mdl
——
分子量
292.375
InChiKey
FUBBMUWBTVRWRE-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):
    2
  • 重原子数:
    21
  • 可旋转键数:
    2
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.71
  • 拓扑面积:
    71.4
  • 氢给体数:
    1
  • 氢受体数:
    4

反应信息

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文献信息

  • Synthesis of a novel tetracationic acidic organic salt based on DABCO and its applications as catalyst in the Knoevenagel condensation reactions in water
    作者:Azim Ziyaei Halimehjani、Vahid Barati、Mahshad Karimi
    DOI:10.1080/00397911.2019.1570268
    日期:2019.3.4
    Abstract Synthesis of a novel tetracationic acidic organic salt based on DABCO containing two sulfonic acid groups in the skeleton and four hydrogensulfate groups as counterion is described. Its catalytic efficiency in the Knoevenagel condensation of aldehydes with active cyclic methylene compounds in water is investigated. While 2,2'-(phenylmethylene)bis(3-hydroxy-5,5-dimethylcyclohex-2-enone) derivatives
    摘要 描述了一种基于 DABCO 的新型四阳离子酸性有机盐的合成,该盐在骨架中含有两个磺酸基团和四个硫酸氢基团作为抗衡离子。研究了其在醛与活性环状亚甲基化合物在水中的 Knoevenagel 缩合中的催化效率。虽然在醛与二甲酮的反应中以 40-98% 的分离产率获得了 2,2'-(苯基亚甲基)双(3-羟基-5,5-二甲基环己-2-烯酮)衍生物,但相应的 Knoevenagel 加合物在使用 1,3-二甲基巴比妥酸的产率为 85-95%。此外,首次制备并表征了基于 DABCO 的聚阳离子有机盐聚合物。图形概要
  • ACTIVATION OF HISTONE DEACETYLASE 1 (HDAC1) PROTECTS AGAINST DNA DAMAGE AND INCREASES NEURONAL SURVIVAL
    申请人:Tsai Li-Huei
    公开号:US20100075926A1
    公开(公告)日:2010-03-25
    The invention provides methods and compounds for the treatment of neurological disorders, including Alzheimer's disease, Parkinson's disease, Huntington's disease, ALS (Amyotrophic Lateral Sclerosis), traumatic brain injury, ischemic brain injury or a stroke. In one aspect the compounds are HDAC1 activators. Exemplary HDAC1 activators include metal chelators, iron chelators, deferoxamin, flavonoids, compounds comprising a catechol moity, ginkgetin K, Chembridge 5104434, sciadopilysin, tetrahydrogamboic acid, TAM-11, LY 235959, CGS 19755, SK&F 97541, etidronic acid, levonordefrin, methyldopa, ampicillin trihydrate, D-aspartic acid, gamma-D-glutamylaminomethylsulfonic acid, phenazopyridine to hydrochloride, oxalamine citrate salt, podophyllotoxin, SK&F 97541, (+-)-4-amino-3-(5-chloro-2-thienyl)-butanoic acid, (RS)-(tetrazol-5-yl) glycine, R(+)-SKF-81297, gambogic acid, and derivatives thereof.
  • [EN] ACTIVATIQN OF HISTONE DEACETYLASE 1 (HDAC1) PROTECTS AGAINST DNA DAMAGE AND INCREASES NEURONAL SURVIVAL<br/>[FR] L'ACTIVATION DE L'HISTONE DÉSACÉTYLASE 1 (HDAC1) PROTÈGE CONTRE DES LÉSIONS DE L'ADN ET AUGMENTE LA SURVIE NEURONALE
    申请人:MASSACHUSETTS INST TECHNOLOGY
    公开号:WO2010011318A2
    公开(公告)日:2010-01-28
    The invention provides methods and compounds for the treatment of neurological disorders, including Alzheimer's disease, Parkinson's disease, Huntington's disease, ALS (Amyotrophic Lateral Sclerosis), traumatic brain injury, ischemic brain injury or a stroke. In one aspect the compounds are HDACl activators. Exemplary HDACl activators include metal chelators, iron chelators, deferoxamin, flavonoids, compounds comprising a catechol moity, ginkgetin K, Chembridge 5104434, sciadopilysin, tetrahydrogamboic acid, TAM-11, LY 235959, CGS 19755, SK&F 97541, etidronic acid, levonordefrin, methyldopa, ampicillin trihydrate, D-aspartic acid, gamma-D-glutamylaminomethylsulfonic acid, phenazopyridine hydrochloride, oxalamine citrate salt, podophyllotoxin, SK&F 97541, (+-)-4-amino-3-(5- chloro-2-thienyl)-butanoic acid, (RS)-(tetrazol-5-yl) glycine, R(+)-SKF-81297, gambogic acid, and derivatives thereof.
  • MUNSHI, HUSHIDER B.;RAMA, RAO K. V. S.;MAHADEVA, IYER R., ATMOS. ENVIRON., 23,(1989) N, C. 1945-1948
    作者:MUNSHI, HUSHIDER B.、RAMA, RAO K. V. S.、MAHADEVA, IYER R.
    DOI:——
    日期:——
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