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(6R)-9-[(2S,3R)-3-hydroxy-6-(2-hydroxyethylidene)-2-methyloxepan-2-yl]-2,6-dimethylnon-2-en-5-one

中文名称
——
中文别名
——
英文名称
(6R)-9-[(2S,3R)-3-hydroxy-6-(2-hydroxyethylidene)-2-methyloxepan-2-yl]-2,6-dimethylnon-2-en-5-one
英文别名
——
(6R)-9-[(2S,3R)-3-hydroxy-6-(2-hydroxyethylidene)-2-methyloxepan-2-yl]-2,6-dimethylnon-2-en-5-one化学式
CAS
——
化学式
C20H34O4
mdl
——
分子量
338.5
InChiKey
XRDHAXIOHKTIGF-AHRSYUTCSA-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):
    2.3
  • 重原子数:
    24
  • 可旋转键数:
    8
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.75
  • 拓扑面积:
    66.8
  • 氢给体数:
    2
  • 氢受体数:
    4

文献信息

  • Synthesis of 1RS,4SR,5RS-4-(4,8-dimethyl-5-hydroxy-7-nonen-1-yl)-4-methyl-3,8-dioxabicyclo(3.2.1)octane-1-acetic acid and intermediates
    申请人:ORTHO PHARMACEUTICAL CORPORATION
    公开号:EP0021775A1
    公开(公告)日:1981-01-07
    A method of synthesizing -1RS,4SR,5RS-4-(4,8 -dimethyl-5-hydroxy-7-nonen-1-yl)-4-methyl-3,8-dioxabicyclo [3.2.1]octane-1-acetic acid. The acid is a derivative of the natural product zoapatanol, one of the active ingredients in the zoapatle plant, and is active as a utero-evacuant agent.
    一种合成-1RS,4SR,5RS-4-(4,8-二甲基-5-羟基-7-壬烯-1-基)-4-甲基-3,8-二氧杂环[3.2.1]辛烷-1-乙酸的方法。 该酸是天然产品zoapatanol的衍生物,zoapatanol是zoapatle植物中的活性成分之一,具有子宫缓释剂的活性。
  • Total synthesis of 1RS,4SR,5RS-4-(4,8-dimethyl-5-hydroxy-7-nonen-1-yl)-4-methyl-3,8-dioxabicyclo(3.2.1)octane-1-acetic acid and related compounds
    申请人:ORTHO PHARMACEUTICAL CORPORATION
    公开号:EP0039595A1
    公开(公告)日:1981-11-11
    The synthesis of 1RS, 4SR, 5RS-4-(4,8-dimethyl-5-hydroxy-7-nonen-1-yl)-4-methyl-3,8-dioxabicyclo[3.2.1]octane-1-acetic acid and related compounds is described and their pharmacological activities are described.
    描述了 1RS、4SR、5RS-4-(4,8-二甲基-5-羟基-7-壬烯-1-基)-4-甲基-3,8-二氧杂环[3.2.1]辛烷-1-乙酸和相关化合物的合成及其药理活性。 及其相关化合物,并介绍了它们的药理活性。
  • Synthesis of dioxabicyclo(3.2.1)octanes and oxepanes
    申请人:——
    公开号:EP0045631A3
    公开(公告)日:1983-07-06
    The synthesis of C-4 alkyl analogs of racemic (1 RS,4SR,5RS)-4-(4,8-dimethyl-5-hydroxy-7-nonenyl)-4-methyl-3,8-dioxabicyclo[3.2.1]octane-1-acetic acid and the corresponding (1RS,4RS,5RS)- derivative is described. The dioxabicyclo[3.2.1]octanes are useful as contragestational agents. The intermediate oxepane analogs are useful as intermediates in the preparation of the contragestational agent zoapatanol.
    介绍了外消旋(1RS,4SR,5RS)-4-(4,8-二甲基-5-羟基-7-壬烯基)-4-甲基-3,8-二氧杂环[3.2.1]辛烷-1-乙酸的 C-4 烷基类似物和相应的(1RS,4RS,5RS)-衍生物的合成。二氧杂环[3.2.1]辛烷可用作避孕药。中间体氧杂环庚烷类似物可用作制备避孕药佐帕他醇的中间体。
  • Total synthesis of 1RS,4SR,5RS-4-(4,8-dimethyl-5-hydroxy-7-nonen-1-yl)-4-methyl-3,8-dioxabicyclo(3.2.1)octane-1-acetic acid
    申请人:ORTHO PHARMACEUTICAL CORPORATION
    公开号:EP0046679A2
    公开(公告)日:1982-03-03
    The synthesis of 1RS,4RS,5RS-4-(4,8-dimethyl-5-hydroxy-7-nonen-1-yl)-4-methyl-3,8-dioxabicyclo[3.2.1]-octane-1-acetic acid, is described. The bicyclo acetic acid compound is useful as a uteroevacuant agent.
    描述了 1RS、4RS、5RS-4-(4,8-二甲基-5-羟基-7-壬烯-1-基)-4-甲基-3,8-二氧杂环[3.2.1]辛烷-1-乙酸的合成。该双环乙酸化合物可用作子宫活化剂。
  • 1-Tosloxy-2,2-ethylenedioxy-6,10-dimethyl undecanes and undecenes, process for the preparation of 2S*,3R*-3-benzyloxy-6,6-ethylene dioxy-2-methyl-2-(5'-hydroxy-4'-methylpentyl)-oxepane, and use of the latter for the preparation of oxepan-3-ol derivatives
    申请人:ORTHO PHARMACEUTICAL CORPORATION
    公开号:EP0012622B1
    公开(公告)日:1982-12-15
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同类化合物

(5β,6α,8α,10α,13α)-6-羟基-15-氧代黄-9(11),16-二烯-18-油酸 (3S,3aR,8aR)-3,8a-二羟基-5-异丙基-3,8-二甲基-2,3,3a,4,5,8a-六氢-1H-天青-6-酮 (2Z)-2-(羟甲基)丁-2-烯酸乙酯 (2S,4aR,6aR,7R,9S,10aS,10bR)-甲基9-(苯甲酰氧基)-2-(呋喃-3-基)-十二烷基-6a,10b-二甲基-4,10-dioxo-1H-苯并[f]异亚甲基-7-羧酸盐 (1aR,4E,7aS,8R,10aS,10bS)-8-[((二甲基氨基)甲基]-2,3,6,7,7a,8,10a,10b-八氢-1a,5-二甲基-氧杂壬酸[9,10]环癸[1,2-b]呋喃-9(1aH)-酮 (+)顺式,反式-脱落酸-d6 龙舌兰皂苷乙酯 龙脑香醇酮 龙脑烯醛 龙脑7-O-[Β-D-呋喃芹菜糖基-(1→6)]-Β-D-吡喃葡萄糖苷 龙牙楤木皂甙VII 龙吉甙元 齿孔醇 齐墩果醛 齐墩果酸苄酯 齐墩果酸甲酯 齐墩果酸溴乙酯 齐墩果酸二甲胺基乙酯 齐墩果酸乙酯 齐墩果酸3-O-alpha-L-吡喃鼠李糖基(1-3)-beta-D-吡喃木糖基(1-3)-alpha-L-吡喃鼠李糖基(1-2)-alpha-L-阿拉伯糖吡喃糖苷 齐墩果酸 beta-D-葡萄糖酯 齐墩果酸 beta-D-吡喃葡萄糖基酯 齐墩果酸 3-乙酸酯 齐墩果酸 3-O-beta-D-葡吡喃糖基 (1→2)-alpha-L-吡喃阿拉伯糖苷 齐墩果酸 齐墩果-12-烯-3b,6b-二醇 齐墩果-12-烯-3,24-二醇 齐墩果-12-烯-3,21,23-三醇,(3b,4b,21a)-(9CI) 齐墩果-12-烯-3,21,23-三醇,(3b,4b,21a)-(9CI) 齐墩果-12-烯-3,11-二酮 齐墩果-12-烯-2α,3β,28-三醇 齐墩果-12-烯-29-酸,3,22-二羟基-11-羰基-,g-内酯,(3b,20b,22b)- 齐墩果-12-烯-28-酸,3-[(6-脱氧-4-O-b-D-吡喃木糖基-a-L-吡喃鼠李糖基)氧代]-,(3b)-(9CI) 齐墩果-12-烯-28-酸,3,7-二羰基-(9CI) 齐墩果-12-烯-28-酸,3,21,29-三羟基-,g-内酯,(3b,20b,21b)-(9CI) 鼠特灵 鼠尾草酸醌 鼠尾草酸 鼠尾草酚酮 鼠尾草苦内脂 黑蚁素 黑蔓醇酯B 黑蔓醇酯A 黑蔓酮酯D 黑海常春藤皂苷A1 黑檀醇 黑果茜草萜 B 黑五味子酸 黏黴酮 黏帚霉酸