HRID195731

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID302426

未命名化合物

结构：COC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CO)NC(=O)C(N)Cc1c[nH]c2ccccc12

HCID178499960

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CO)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(CCC(N)=O)NC(=O)OCc1ccccc1

HCID178499958

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c1550ec3dc9841839224bb7085603b6d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH2:36]([c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)[O:43][C:44](=[O:45])[NH:46][CH:47]([CH2:48][CH2:49][C:50]([NH2:51])=[O:52])[C:53](=[O:54])[OH:55].[CH3:2][O:3][C:4]([CH:5]([NH:6][C:7]([CH:8]([NH:9][C:10]([CH:11]([NH2:12])[CH2:13][c:14]1[cH:15][nH:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]12)=[O:23])[CH2:24][OH:25])=[O:26])[CH2:27][c:28]1[cH:29][cH:30][c:31]([OH:34])[cH:32][cH:33]1)=[O:35].[CH3:81][CH2:82][N:83]([CH2:84][CH3:85])[CH2:86][CH3:87].[CH3:88][N:89]([CH3:90])[CH:91]=[O:92].[CH:66]1([N:67]=[C:68]=[N:69][CH:70]2[CH2:71][CH2:72][CH2:73][CH2:74][CH2:75]2)[CH2:76][CH2:77][CH2:78][CH2:79][CH2:80]1.[ClH:1].[OH:56][n:57]1[c:58]2[cH:59][cH:60][cH:61][cH:62][c:63]2[n:64][n:65]1>>[CH3:2][O:3][C:4]([CH:5]([NH:6][C:7]([CH:8]([NH:9][C:10]([CH:11]([NH:12][C:53]([CH:47]([NH:46][C:44]([O:43][CH2:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)=[O:45])[CH2:48][CH2:49][C:50]([NH2:51])=[O:52])=[O:54])[CH2:13][c:14]1[cH:15][nH:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]12)=[O:23])[CH2:24][OH:25])=[O:26])[CH2:27][c:28]1[cH:29][cH:30][c:31]([OH:34])[cH:32][cH:33]1)=[O:35]