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2-[[(E)-octadec-9-enoyl]amino]ethanesulfonic acid

中文名称
——
中文别名
——
英文名称
2-[[(E)-octadec-9-enoyl]amino]ethanesulfonic acid
英文别名
——
2-[[(E)-octadec-9-enoyl]amino]ethanesulfonic acid化学式
CAS
——
化学式
C20H39NO4S
mdl
——
分子量
389.6
InChiKey
KOGRJTUIKPMZEJ-MDZDMXLPSA-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):
    5.9
  • 重原子数:
    26
  • 可旋转键数:
    18
  • 环数:
    0.0
  • sp3杂化的碳原子比例:
    0.85
  • 拓扑面积:
    91.8
  • 氢给体数:
    2
  • 氢受体数:
    4

文献信息

  • CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF
    申请人:MedWell Laboratories Ltd.
    公开号:US20160120995A1
    公开(公告)日:2016-05-05
    Novel chemical conjugates derived from unsaturated fatty acids and therapeutically active agents, are disclosed. The chemical conjugates are designed and characterized as COX-2 and/or 5-LOX inhibitors and are useful in the treatment of inflammatory diseases, dermatitis and disorders such as Alzheimer's disease, Parkinson's disease, asthma, osteoarthritis, rheumatoid arthritis, pain, primary dysmenorrhea, Crohn's disease and ulcerative colitis.
    本发明揭示了从不饱和脂肪酸和治疗活性剂衍生的新型化学共轭物。这些化学共轭物被设计和表征为COX-2和/或5-LOX抑制剂,并可用于治疗炎症性疾病、皮炎和阿尔茨海默病、帕金森病、哮喘、骨关节炎、类风湿性关节炎、疼痛、原发性痛经、克罗恩病和溃疡性结肠炎等疾病。
  • [EN] CONJUGATES OF POLYUNSATURATED FATTY ACIDS AND AMINE-CONTAINING COMPOUNDS AND USES THEREOF<br/>[FR] CONJUGUÉS D'ACIDES GRAS POLYINSATURÉS ET DE COMPOSÉS CONTENANT DES AMINES ET LEURS UTILISATIONS
    申请人:MEDWELL LAB LTD
    公开号:WO2012032509A2
    公开(公告)日:2012-03-15
    Novel chemical conjugates derived from unsaturated fatty acids and therapeutically active agents, are disclosed. The chemical conjugates are designed and characterized as COX-2 and/or 5-LOX inhibitors and are useful in the treatment of inflammatory diseases and disorders such as Alzheimer's disease, Parkinson's disease, asthma, osteoarthritis, rheumatoid arthritis, pain, primary dysmenorrhea, Crohn's disease and ulcerative colitis.
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