HRID1230078

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7774

Dibutyl but-2-enedioate

C12H20O4

HCID8471

Triethylamine

C6H15N

HCID70370

2,6-Di-tert-butyl-4-mercaptophenol

C14H22OS

PRODUCTS

生成物

结构：CCCCOC(=O)CC(Sc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)C(=O)OCCCC

HCID20263298

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0ebdd96915f44b2684bfe4ab03bf4b76
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:17]([CH:18]=[CH:19][C:20](=[O:21])[O:22][CH2:23][CH2:24][CH2:25][CH3:26])(=[O:27])[O:28][CH2:29][CH2:30][CH2:31][CH3:32].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([OH:16])[c:7]([C:12]([CH3:13])([CH3:14])[CH3:15])[cH:8][c:9]([SH:11])[cH:10]1.[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([OH:16])[c:7]([C:12]([CH3:13])([CH3:14])[CH3:15])[cH:8][c:9]([S:11][CH:18]([C:17](=[O:27])[O:28][CH2:29][CH2:30][CH2:31][CH3:32])[CH2:19][C:20](=[O:21])[O:22][CH2:23][CH2:24][CH2:25][CH3:26])[cH:10]1