HRID813645

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID3776

Isopropanol

C3H8O

HCID6342

Acetonitrile

C2H3N

HCID30165

Iodide ion

I-

HCID23078896

未命名化合物

结构：Cc1cc(OCCCCl)ccc1Cc1c(OC2OC(COC(=O)C(C)(C)C)C(OC(=O)C(C)(C)C)C(OC(=O)C(C)(C)C)C2OC(=O)C(C)(C)C)n[nH]c1C(C)C

HCID178429027

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(OCCCNC(C)(C)CC(=O)OCc2ccccc2)ccc1Cc1c(OC2OC(COC(=O)C(C)(C)C)C(OC(=O)C(C)(C)C)C(OC(=O)C(C)(C)C)C2OC(=O)C(C)(C)C)n[nH]c1C(C)C

HCID178429037

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6f4d21ac30184a609d4c60ce475275e7
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:75][C:76]#[N:77].[CH3:78][CH:79]([OH:80])[CH3:81].[Cl:1][CH2:2][CH2:3][CH2:4][O:5][c:6]1[cH:7][c:8]([CH3:57])[c:9]([CH2:12][c:13]2[c:14]([O:21][CH:22]3[CH:23]([O:24][C:25]([C:26]([CH3:27])([CH3:28])[CH3:29])=[O:30])[CH:31]([O:32][C:33]([C:34]([CH3:35])([CH3:36])[CH3:37])=[O:38])[CH:39]([O:40][C:41]([C:42]([CH3:43])([CH3:44])[CH3:45])=[O:46])[CH:47]([CH2:49][O:50][C:51]([C:52]([CH3:53])([CH3:54])[CH3:55])=[O:56])[O:48]3)[n:15][nH:16][c:17]2[CH:18]([CH3:19])[CH3:20])[cH:10][cH:11]1.[I-:59].[NH2:60][C:61]([CH2:62][C:63](=[O:64])[O:65][CH2:66][c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1)([CH3:73])[CH3:74].[Na+:58]>>[CH2:2]([CH2:3][CH2:4][O:5][c:6]1[cH:7][c:8]([CH3:57])[c:9]([CH2:12][c:13]2[c:14]([O:21][CH:22]3[CH:23]([O:24][C:25]([C:26]([CH3:27])([CH3:28])[CH3:29])=[O:30])[CH:31]([O:32][C:33]([C:34]([CH3:35])([CH3:36])[CH3:37])=[O:38])[CH:39]([O:40][C:41]([C:42]([CH3:43])([CH3:44])[CH3:45])=[O:46])[CH:47]([CH2:49][O:50][C:51]([C:52]([CH3:53])([CH3:54])[CH3:55])=[O:56])[O:48]3)[n:15][nH:16][c:17]2[CH:18]([CH3:19])[CH3:20])[cH:10][cH:11]1)[NH:60][C:61]([CH2:62][C:63](=[O:64])[O:65][CH2:66][c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1)([CH3:73])[CH3:74]