HRID682758

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3301

Ethylenediamine

C2H8N2

HCID6344

Dichloromethane

CH2Cl2

结构：COC(=O)c1nc(NCC(c2ccccc2)c2ccccc2)c2ncn(C3OC(CO)C(O)C3O)c2n1

HCID21978249

未命名化合物

PRODUCTS

生成物

结构：NCCNC(=O)c1nc(NCC(c2ccccc2)c2ccccc2)c2ncn(C3OC(CO)C(O)C3O)c2n1

HCID21978244

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3e761a8220d74891bc2db026913b4ce8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH2:38]([CH2:39][NH2:40])[NH2:41].[Cl:42][CH2:43][Cl:44].[OH:1][CH:2]1[CH:3]([n:10]2[c:11]3[n:12][c:13]([C:34]([O:36][CH3:35])=[O:37])[n:14][c:15]([NH:19][CH2:20][CH:21]([c:22]4[cH:23][cH:24][cH:25][cH:26][cH:27]4)[c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:16]3[n:17][cH:18]2)[O:4][CH:5]([CH2:8][OH:9])[CH:6]1[OH:7]>>[OH:1][CH:2]1[CH:3]([n:10]2[c:11]3[n:12][c:13]([C:34](=[O:36])[NH:41][CH2:38][CH2:39][NH2:40])[n:14][c:15]([NH:19][CH2:20][CH:21]([c:22]4[cH:23][cH:24][cH:25][cH:26][cH:27]4)[c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:16]3[n:17][cH:18]2)[O:4][CH:5]([CH2:8][OH:9])[CH:6]1[OH:7]