HRID1238718

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID7397

p-Toluenesulfonyl chloride

C7H7ClO2S

HCID21885

2-Dimethylaminopyridine

C7H10N2

结构：COC(=O)C(c1ccccc1)C(O)CCCCNC(=O)OCc1ccccc1

HCID18980747

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(c1ccccc1)C(CCCCNC(=O)OCc1ccccc1)OS(=O)(=O)c1ccc(C)cc1

HCID18980749

methyl 7-(N-benzyloxycarbonylamino)-3-p-toluenesulfonyloxy-2-phenylheptanoate

C29H33NO7S

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c948bb3a4fb345f1a8573a23e2674b7a
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

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