HRID1227374

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID12734

Diisopropylcarbodiimide

C7H14N2

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID11564634

4-methyl-4-(methyldisulfanyl)pentanoic acid

C7H14O2S2

HCID67032281

未命名化合物

PRODUCTS

生成物

结构：CSSC(C)(C)CCC(=O)N1CCN(CCOc2cc(CO)nc(CO)c2)CC1

HCID86671293

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-66351bdd31c44fd4811fde2eef812fac
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

[CH3:1][C:2]([CH2:3][CH2:4][C:5](=[O:6])[OH:7])([CH3:8])[S:9][S:10][CH3:11].[CH:12]([N:13]=[C:14]=[N:15][CH:16]([CH3:17])[CH3:18])([CH3:19])[CH3:20].[N:32]1([CH2:38][CH2:39][O:40][c:41]2[cH:42][c:43]([CH2:49][OH:50])[n:44][c:45]([CH2:47][OH:48])[cH:46]2)[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]1.[O:51]=[CH:52][N:53]([CH3:54])[CH3:55].[OH2:21].[OH:22][n:23]1[c:24]2[cH:25][cH:26][cH:27][cH:28][c:29]2[n:30][n:31]1>>[CH3:1][C:2]([CH2:3][CH2:4][C:5](=[O:7])[N:35]1[CH2:34][CH2:33][N:32]([CH2:38][CH2:39][O:40][c:41]2[cH:42][c:43]([CH2:49][OH:50])[n:44][c:45]([CH2:47][OH:48])[cH:46]2)[CH2:37][CH2:36]1)([CH3:8])[S:9][S:10][CH3:11]