HRID1582822

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：C=CCCCCCC(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(=O)OCC

HCID12048018

未命名化合物

结构：C=CC[C@@H]1Cc2cc(OC)ccc2[C@H]2CC[C@]3(C)[C@@H](O)CC[C@H]3[C@H]12

HCID69414807

未命名化合物

PRODUCTS

生成物

结构：C[C@]12CC[C@@H]3c4ccc(O)cc4C[C@@H](CCCCCCCCC(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(=O)O)[C@H]3[C@@H]1CC[C@@H]2O

HCID53318530

10-[3,17beta-Dihydroxyestra-1,3,5(10)-trien-7alpha-yl]-2-[2-(perfluorobutyl)ethyl]decanoic acid

C34H45F9O4

PROCEDURE

实验过程

Starting with the 3-methoxy-7α-(2-propenyl)estra-1,3,5(10)-trien-17β-ol prepared in Example 13 and ethyl 2-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)-8-nonenoate prepared separately, the same procedure as shown in Example 13 was repeated to give 10-[3,17β-dihydroxyestra-1,3,5(10)-trien-7α-yl]-2-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)decanoic acid.

WORKUP

后处理

customprepared separately

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8af89f346de045ffa6b99b0b79a761ca
来源数据集: uspto-grants-2004_05
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06737417B2
来源说明: uspto-grants-2004_05

反应 SMILES

C[O:2][C:3]1[CH:20]=[CH:19][C:18]2[C@@H:17]3[C@H:8]([C@H:9]4[C@@:13]([CH2:15][CH2:16]3)([CH3:14])[C@@H:12]([OH:21])[CH2:11][CH2:10]4)[C@H:7]([CH2:22][CH:23]=[CH2:24])[CH2:6][C:5]=2[CH:4]=1.[F:25][C:26]([F:52])([C:42]([F:51])([F:50])[C:43]([F:49])([F:48])[C:44]([F:47])([F:46])[F:45])[CH2:27][CH2:28][CH:29]([CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]C=C)[C:30]([O:32]CC)=[O:31]>>[OH:2][C:3]1[CH:20]=[CH:19][C:18]2[C@@H:17]3[C@H:8]([C@H:9]4[C@@:13]([CH2:15][CH2:16]3)([CH3:14])[C@@H:12]([OH:21])[CH2:11][CH2:10]4)[C@H:7]([CH2:6][CH2:5][CH2:4][CH2:39][CH2:38][CH2:37][CH2:36][CH2:35][CH:29]([CH2:28][CH2:27][C:26]([F:25])([F:52])[C:42]([F:50])([F:51])[C:43]([F:48])([F:49])[C:44]([F:45])([F:47])[F:46])[C:30]([OH:32])=[O:31])[CH2:22][C:23]=2[CH:24]=1