HRID283463

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID7972

4-Methylmorpholine

C5H11NO

HCID8071

未命名化合物

HCID28123

Tetrahydroborate

H4B-

HCID62365

Isobutyl chloroformate

C5H9ClO2

结构：CC(C)(C)OC(=O)N1CCN(C(=O)OCc2ccccc2)CC1C(=O)O

HCID2756778

4-[(Benzyloxy)carbonyl]-1-(tert-butoxycarbonyl)piperazine-2-carboxylic acid

C18H24N2O6

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCN(C(=O)OCc2ccccc2)CC1CO

HCID18375954

4-Benzyl 1-tert-butyl 2-(hydroxymethyl)piperazine-1,4-dicarboxylate

C18H26N2O5

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-057f51b65d4946bc86f4761022a587e9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[BH4-:42].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]1[CH2:12][CH:13]([C:24](=[O:25])[OH:26])[N:14]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:15][CH2:16]1.[CH2:44]([CH2:45][O:46][CH3:47])[O:48][CH3:49].[CH3:27][N:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1.[Cl:34][C:35]([O:36][CH2:37][CH:38]([CH3:39])[CH3:40])=[O:41].[Na+:43].[OH2:50]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]1[CH2:12][CH:13]([CH2:24][OH:25])[N:14]([C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[CH2:15][CH2:16]1