HRID1543570

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID8857

Ethyl acetate

C4H8O2

HCID28486

Lithium ion

Li+

HCID33558

Azide

N3-

结构：CC(=O)NC1C(Cl)OC(COC(C)=O)C(OC(C)=O)C1OC(C)=O

HCID102933

未命名化合物

结构：CC(=O)NC1C(Br)OC(COC(C)=O)C(OC(C)=O)C1OC(C)=O

HCID14370480

未命名化合物

PRODUCTS

生成物

结构：CC(=O)NC1C(N)OC(COC(C)=O)C(OC(C)=O)C1OC(C)=O

HCID4131036

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-71873c414a664aa5bcea22790b0e3022
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:1]([CH3:2])(=[O:3])[NH:4][CH:5]1[CH:6]([Br:24])[O:7][CH:8]([CH2:19][O:20][C:21]([CH3:22])=[O:23])[CH:9]([O:15][C:16]([CH3:17])=[O:18])[CH:10]1[O:11][C:12]([CH3:13])=[O:14].[C:33]([NH:34][CH:35]1[CH:36]([O:37][C:38](=[O:39])[CH3:40])[CH:41]([O:42][C:43](=[O:44])[CH3:45])[CH:46]([CH2:47][O:48][C:49](=[O:50])[CH3:51])[O:52][CH:53]1[Cl:54])(=[O:55])[CH3:56].[CH3:29][C:30](=[O:31])[CH3:32].[CH3:62][CH2:63][O:64][C:65](=[O:66])[CH3:67].[CH:57]([Cl:58])([Cl:59])[Cl:60].[Li+:28].[N-:25]=[N+:26]=[N-:27].[OH2:61]>>[C:1]([CH3:2])(=[O:3])[NH:4][CH:5]1[CH:6]([NH2:25])[O:7][CH:8]([CH2:19][O:20][C:21]([CH3:22])=[O:23])[CH:9]([O:15][C:16]([CH3:17])=[O:18])[CH:10]1[O:11][C:12]([CH3:13])=[O:14]