HRID687808

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID888

Magnesium cation

Mg+2

HCID923

Sodium ion

Na+

HCID1117

Sulfate

O4S-2

HCID8028

Tetrahydrofuran

C4H8O

HCID498716

未命名化合物

HCID4439981

2-Amino-3-(phenylmethoxy)-1-propanol

C10H15NO2

HCID86236681

未命名化合物

PRODUCTS

生成物

结构：CC(NC(CO)COCc1ccccc1)C(OCC(C)(C)C)OCC(C)(C)C

HCID178464480

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c607072bc0434e64aa4855683460986e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[C:36]([BH3-:37])#[N:38].[CH3:20][C:21]([CH2:22][O:23][CH:24]([C:25]([CH3:26])=[O:27])[O:28][CH2:29][C:30]([CH3:31])([CH3:32])[CH3:33])([CH3:34])[CH3:35].[CH3:40][C:41](=[O:42])[OH:43].[Mg+2:1].[NH2:7][CH:8]([CH2:9][OH:10])[CH2:11][O:12][CH2:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1.[Na+:39].[O-:2][S:3](=[O:4])(=[O:5])[O-:6].[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1>>[NH:7]([CH:8]([CH2:9][OH:10])[CH2:11][O:12][CH2:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[CH:25]([CH:24]([O:23][CH2:22][C:21]([CH3:20])([CH3:34])[CH3:35])[O:28][CH2:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH3:26]