HRID98099

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6344

Dichloromethane

CH2Cl2

HCID15908

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

C8H17N3

HCID81531

Diisopropylethylamine

C8H19N

HCID181649

HOAt

C5H4N4O

HCID10802217

未命名化合物

HCID22326951

未命名化合物

PRODUCTS

产物

HCID20827574

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-3b9fafec0cd84f42b0e2d49b14e9dab1
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([CH2:14][O:15][CH2:16][C:17](=[O:18])[OH:19])[CH2:10][CH2:11][CH2:12][CH2:13]1.[CH2:31]([N:32]=[C:33]=[N:34][CH2:35][CH2:36][CH2:37][N:38]([CH3:39])[CH3:40])[CH3:41].[CH3:42][N:43]([C:44]([CH:45]([CH2:46][c:47]1[cH:48][c:49]2[cH:50][cH:51][cH:52][cH:53][c:54]2[cH:55][cH:56]1)[NH:57][CH3:58])=[O:59])[CH:60]([CH2:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1)[C:68]([NH:69][CH3:70])=[O:71].[CH:72]([N:73]([CH:74]([CH3:75])[CH3:76])[CH2:77][CH3:78])([CH3:79])[CH3:80].[Cl:81][CH2:82][Cl:83].[ClH:30].[OH:20][n:21]1[c:22]2[n:23][cH:24][cH:25][cH:26][c:27]2[n:28][n:29]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([CH2:14][O:15][CH2:16][C:17](=[O:19])[N:57]([CH:45]([C:44]([N:43]([CH3:42])[CH:60]([CH2:61][c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[C:68]([NH:69][CH3:70])=[O:71])=[O:59])[CH2:46][c:47]2[cH:48][c:49]3[cH:50][cH:51][cH:52][cH:53][c:54]3[cH:55][cH:56]2)[CH3:58])[CH2:10][CH2:11][CH2:12][CH2:13]1