HRID140974

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID312

Chloride

Cl-

HCID313

Hydrochloric Acid

ClH

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID962

Water

H2O

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID58256474

未命名化合物

PRODUCTS

生成物

HCID44610370

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a246c31b58334846b330ec218e1a4dcd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:67](=[O:68])([OH:69])[O-:70].[CH2:45]([N:46]=[C:47]=[N:48][CH2:49][CH2:50][CH2:51][N:52]([CH3:53])[CH3:54])[CH3:55].[CH3:56][N:57]([CH3:58])[CH:59]=[O:60].[CH3:61][CH2:62][O:63][C:64](=[O:65])[CH3:66].[CH:24]([N:27]([CH2:25][CH3:26])[CH:28]([CH3:29])[CH3:30])([CH3:31])[CH3:32].[Cl-:22].[ClH:44].[NH4+:23].[NH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[s:9][c:10](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:11][c:12]1[C:13](=[O:14])[OH:15].[Na+:71].[OH2:33].[OH2:72].[OH:34][n:35]1[c:36]2[cH:37][cH:38][cH:39][cH:40][c:41]2[n:42][n:43]1>>[NH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[s:9][c:10](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:11][c:12]1[C:13](=[O:14])[NH2:27]