HRID1779217

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID68030835

未命名化合物

结构：CC#CCOc1ccc(C[C@H](NC(=O)[C@@H](/C=C/CCCCCCC(=O)CCCCCCC)[C@@](O)(CC(F)F)C(=O)O)C(=O)OC)cc1

HCID118157889

未命名化合物

结构：CCCCOc1ccc(C[C@H](N)C(=O)OC(C)(C)C)cc1

HCID131734865

未命名化合物

PRODUCTS

生成物

结构：CCCCCCCC(=O)CCCCCC/C=C/[C@H](C(=O)N[C@@H](Cc1ccc(OCCCC)cc1)C(=O)O)[C@@](O)(CC(F)F)C(=O)O

HCID118157849

未命名化合物

PROCEDURE

实验过程

The title compound was synthesized by a method similar to that of No. 5509214, (E)-(2S,3S)-3-[(S)-2-(4-but-2-ynyloxy-phenyl)-1-methoxycarbonyl-ethylcarbamoyl]-2-(2,2-difluoro-ethyl)-2-hydroxy-12-oxo-nonadec-4-enoic acid, except that tert-butyl (S)-2-amino-3-(4-butoxy-phenyl)-propionate was used instead of No. 5509214, methyl (S)-2-amino-3-(4-butoxy-phenyl)-propionate.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a31d5709e4174a18ad0127547e124766
来源数据集: uspto-grants-2016_02
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09266853B2
来源说明: uspto-grants-2016_02

反应 SMILES

[CH2:1]([O:5][C:6]1[CH:11]=[CH:10][C:9]([CH2:12][C@H:13]([NH:18][C:19]([C@@H:21](/[CH:31]=[CH:32]/[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][C:39](=[O:47])[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH3:46])[C@:22]([CH2:27][CH:28]([F:30])[F:29])([OH:26])[C:23]([OH:25])=[O:24])=[O:20])[C:14]([O:16]C)=[O:15])=[CH:8][CH:7]=1)[C:2]#[C:3][CH3:4].N[C@@H](CC1C=CC(OCCCC)=CC=1)C(OC(C)(C)C)=O.N[C@@H](CC1C=CC(OCCCC)=CC=1)C(OC)=O>>[CH2:1]([O:5][C:6]1[CH:11]=[CH:10][C:9]([CH2:12][C@H:13]([NH:18][C:19]([C@@H:21](/[CH:31]=[CH:32]/[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][C:39](=[O:47])[CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:45][CH3:46])[C@:22]([CH2:27][CH:28]([F:30])[F:29])([OH:26])[C:23]([OH:25])=[O:24])=[O:20])[C:14]([OH:16])=[O:15])=[CH:8][CH:7]=1)[CH2:2][CH2:3][CH3:4]