HRID1217841

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID1116164

benzyl beta-alaninate

C10H13NO2

HCID76377902

2,2-Dimethylpropanoyloxymethyl 2,4-dibenzyl-5-chloro-5-oxopentanoate

C25H29ClO5

PRODUCTS

产物

HCID70090636

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-3399a3d494f043db89c067fe5278009b
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

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