HRID1227810

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6342

Acetonitrile

C2H3N

HCID15908

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

C8H17N3

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID86078

tert-butyl tyrosinate

C13H19NO3

HCID246673

Z-DL-Leu-OH

C14H19NO4

PRODUCTS

生成物

结构：CC(C)CC(NC(=O)OCc1ccccc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)OC(C)(C)C

HCID178446717

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7500b4173ca04c0ebdec8306ffc7af9a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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