HRID905550

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COc1ccc2c(OC3CC4C(=O)NC5(C(=O)O)CC5C=CCCCCN(C)C(=O)N4C3)nc(Cl)cc2c1

HCID76674825

未命名化合物

HCID178487761

未命名化合物

PRODUCTS

生成物

结构：COc1ccc2c(OC3CC4C(=O)NC5(C(=O)O)CC5C=CCCCCN(C)C(=O)N4C3)nc(-n3cccn3)cc2c1

HCID67387975

未命名化合物

PROCEDURE

实验过程

The title product 67 was prepared from 1-hydroxy-6-methoxy-3-(pyrazol-1-yl)isoquinoline following the same procedures described for the preparation of 17-(3-chloro-6-methoxyisoquinolin-1-yloxy)-13-methyl-2,14-dioxo-3,13,15-triazatricyclo[13.3.0.04,6]octadec-7-ene-4-carboxylic acid (42, Example 10): m/z=575 (M+H)+.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e9940d6b798b4fa8b3e6b838736879a3
来源数据集: uspto-grants-2011_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08012939B2
来源说明: uspto-grants-2011_09

反应 SMILES

[OH:1][C:2]1[C:11]2[C:6](=[CH:7][C:8]([O:12][CH3:13])=[CH:9][CH:10]=2)[CH:5]=[C:4]([N:14]2[CH:18]=[CH:17][CH:16]=[N:15]2)[N:3]=1.ClC1N=C(O[CH:33]2[CH2:50][CH:49]3[N:35]([C:36](=[O:56])[N:37]([CH3:55])[CH2:38][CH2:39][CH2:40][CH2:41][CH:42]=[CH:43][CH:44]4[C:46]([C:52]([OH:54])=[O:53])([NH:47][C:48]3=[O:51])[CH2:45]4)[CH2:34]2)C2C(C=1)=CC(OC)=CC=2>>[N:14]1([C:4]2[N:3]=[C:2]([O:1][CH:33]3[CH2:50][CH:49]4[N:35]([C:36](=[O:56])[N:37]([CH3:55])[CH2:38][CH2:39][CH2:40][CH2:41][CH:42]=[CH:43][CH:44]5[C:46]([C:52]([OH:54])=[O:53])([NH:47][C:48]4=[O:51])[CH2:45]5)[CH2:34]3)[C:11]3[C:6]([CH:5]=2)=[CH:7][C:8]([O:12][CH3:13])=[CH:9][CH:10]=3)[CH:18]=[CH:17][CH:16]=[N:15]1