HRID148486

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID7525

N-Ethylmorpholine

C6H13NO

HCID10868

Dicyclohexylcarbodiimide

C13H22N2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID269698

BOC-DL-Phenylalanine

C14H19NO4

结构：C=CC(CC(O)C(CC1CCCCC1)NC(=O)C(N)Cc1c[nH]cn1)C(C)C

HCID178447062

未命名化合物

PRODUCTS

生成物

结构：C=CC(CC(O)C(CC1CCCCC1)NC(=O)C(Cc1c[nH]cn1)NC(=O)C(Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C

HCID178447052

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4cf69d1eebb646ada94c8fc15641c421
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:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH2:10][c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[C:17](=[O:18])[OH:19].[CH2:48]([N:49]1[CH2:50][CH2:51][O:52][CH2:53][CH2:54]1)[CH3:55].[CH3:81][N:82]([CH3:83])[CH:84]=[O:85].[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.[NH2:20][CH:21]([C:22](=[O:23])[NH:24][CH:25]([CH:26]([CH2:27][CH:28]([CH:29]=[CH2:30])[CH:31]([CH3:32])[CH3:33])[OH:34])[CH2:35][CH:36]1[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]1)[CH2:42][c:43]1[n:44][cH:45][nH:46][cH:47]1.[OH:56][n:57]1[c:58]2[c:59]([cH:60][cH:61][cH:62][cH:63]2)[n:64][n:65]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH2:10][c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[C:17](=[O:19])[NH:20][CH:21]([C:22](=[O:23])[NH:24][CH:25]([CH:26]([CH2:27][CH:28]([CH:29]=[CH2:30])[CH:31]([CH3:32])[CH3:33])[OH:34])[CH2:35][CH:36]1[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41]1)[CH2:42][c:43]1[n:44][cH:45][nH:46][cH:47]1