HRID1574420

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID6228

Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

反应SMILES：CC(C)(C)OC(=O)NCCCCCC(=O)ON1C(=O)CCC1=O

HCID5074016

Boc-6-Ahx-OSu

C15H24N2O6

反应SMILES：NC(CNC(=O)c1ccc2c(cnn2CCCNc2ncc[nH]2)c1)C(=O)O

HCID22598941

未命名化合物

PRODUCTS

产物

反应SMILES：CC(C)(C)OC(=O)NCCCCCC(=O)NC(CNC(=O)c1ccc2c(cnn2CCCNc2ncc[nH]2)c1)C(=O)O

HCID22598980

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-f2d3c9e353d0465da97a88c250f5e8ce
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应SMILES

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