HRID332708

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID521029

1-Amino-3,3-diethoxypropane

C7H17NO2

HCID24726991

4-[(1,3-Dioxolan-2-yl)methyl]benzoic acid

C11H12O4

结构：O=C(NC(c1ccccc1)c1cccc(OCCCO)c1)O[C@H]1CN2CCC1CC2

HCID117680437

未命名化合物

PRODUCTS

生成物

结构：O=C(NC(c1ccccc1)c1cccc(OCCCOC(=O)c2ccc(CC3OCCO3)cc2)c1)O[C@H]1CN2CCC1CC2

HCID71093290

未命名化合物

PROCEDURE

实验过程

The title compound was prepared as described in Chiral Example 11 Step 2 with (R)-quinuclidin-3-yl((3-(3-hydroxypropoxy)phenyl)(phenyl)methyl)carbamate and 4-(1,3-dioxolan-2-ylmethyl)-benzoic acid replacing 4-((3-(phenyl((((R)-quinuclidin-3-yloxy)carbonyl)amino)methyl)phenoxy)methyl)benzoic acid and 1-amino-3,3-diethoxypropane, respectively.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-524c5b4df8eb41febab644e96cd03f8e
来源数据集: uspto-grants-2014_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08877774B2
来源说明: uspto-grants-2014_11

反应 SMILES

[N:1]12[CH2:8][CH2:7][CH:4]([CH2:5][CH2:6]1)[C@@H:3]([O:9][C:10](=[O:30])[NH:11][CH:12]([C:19]1[CH:24]=[CH:23][CH:22]=[C:21]([O:25][CH2:26][CH2:27][CH2:28][OH:29])[CH:20]=1)[C:13]1[CH:18]=[CH:17][CH:16]=[CH:15][CH:14]=1)[CH2:2]2.[O:31]1[CH2:35][CH2:34][O:33][CH:32]1[CH2:36][C:37]1[CH:45]=[CH:44][C:40]([C:41](O)=[O:42])=[CH:39][CH:38]=1.NCCC(OCC)OCC>>[O:31]1[CH2:35][CH2:34][O:33][CH:32]1[CH2:36][C:37]1[CH:45]=[CH:44][C:40]([C:41]([O:29][CH2:28][CH2:27][CH2:26][O:25][C:21]2[CH:22]=[CH:23][CH:24]=[C:19]([CH:12]([C:13]3[CH:14]=[CH:15][CH:16]=[CH:17][CH:18]=3)[NH:11][C:10]([O:9][C@@H:3]3[CH:4]4[CH2:5][CH2:6][N:1]([CH2:8][CH2:7]4)[CH2:2]3)=[O:30])[CH:20]=2)=[O:42])=[CH:39][CH:38]=1