HRID2326740

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

2 次

HCID962

Water

H2O

HCID6212

Chloroform

CHCl3

HCID8471

Triethylamine

C6H15N

HCID8857

Ethyl acetate

C4H8O2

HCID15908

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID136696

3,3,3-Triphenylpropionic acid

C21H18O2

HCID18677077

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)CCNC(=O)CNC(=O)CC(c1ccccc1)(c1ccccc1)c1ccccc1

HCID22647252

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-61898736700f44a3bdb1ae36358eda0d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

[CH2:49]([N:50]=[C:51]=[N:52][CH2:53][CH2:54][CH2:55][N:56]([CH3:57])[CH3:58])[CH3:59].[CH3:64][CH2:65][O:66][C:67](=[O:68])[CH3:69].[CH3:70][CH2:71][N:72]([CH2:73][CH3:74])[CH2:75][CH3:76].[CH:60]([Cl:61])([Cl:62])[Cl:63].[ClH:1].[ClH:48].[NH2:2][CH2:3][C:4](=[O:5])[NH:6][CH2:7][CH2:8][C:9](=[O:10])[O:11][CH2:12][CH3:13].[OH2:37].[OH:38][n:39]1[c:40]2[cH:41][cH:42][cH:43][cH:44][c:45]2[n:46][n:47]1.[c:14]1([C:20]([CH2:21][C:22](=[O:23])[OH:24])([c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[NH:2]([CH2:3][C:4](=[O:5])[NH:6][CH2:7][CH2:8][C:9](=[O:10])[O:11][CH2:12][CH3:13])[C:22]([CH2:21][C:20]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)([c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)=[O:23]