HRID215879

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：O=C(CO)N[C@H]1C[C@@H](n2cnc3c(N[C@H](CO)Cc4ccccc4)nc(Cl)nc32)[C@H](O)[C@@H]1O

HCID86632435

未命名化合物

HCID178526856

未命名化合物

PRODUCTS

生成物

结构：O=C(CO)N[C@H]1C[C@@H](n2cnc3c(N[C@H](CO)Cc4ccccc4)nc(-n4cnc([N+](=O)[O-])c4)nc32)[C@H](O)[C@@H]1O

HCID67022940

未命名化合物

PROCEDURE

实验过程

The title compound can be prepared from N-{(1S,2R,3S,4R)-4-[6-((S)-1-benzyl-2-hydroxy-ethylamino)-2-chloro-purin-9-yl]-2,3-dihydroxy-cyclopentyl}-2-hydroxy-acetamide (Intermediate GC) and 4-nitro-imidazole, as described for N-{(1S,2R,3S,4R)-4-[6-(2,2-diphenyl-ethylamino)-2-(4-nitro-pyrazol-1-yl)-purin-9-yl]-2,3-dihydroxy-cyclopentyl}-2-hydroxy-acetamide (Intermediate QD).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-72877b9721f246e8ae01c62ee1e7fa38
来源数据集: uspto-grants-2012_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08193164B2
来源说明: uspto-grants-2012_06

反应 SMILES

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