HRID1535929

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

2 次

HCID961

Hydroxide

HO-

HCID6344

Dichloromethane

CH2Cl2

HCID6385

tert-Butylamine

C4H11N

HCID114942

Titanium(4+)

Ti+4

HCID498716

未命名化合物

HCID3260420

未命名化合物

4 次

结构：C[Si](C)(C)CCOC(=O)NC1CC(=O)CCC1N1CCC(NC(=O)OCc2ccccc2)C1=O

HCID178504276

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)NC1CCC(N2CCC(NC(=O)OCc3ccccc3)C2=O)C(NC(=O)OCC[Si](C)(C)C)C1

HCID178448805

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f5b7d0cf0d694db5b74e15aa80166733
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[C:35]([CH3:36])([CH3:37])([CH3:38])[NH2:39].[C:40]([BH3-:41])#[N:42].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]1[C:13](=[O:34])[N:14]([CH:17]2[CH:18]([NH:24][C:25]([O:26][CH2:27][CH2:28][Si:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[CH2:19][C:20](=[O:23])[CH2:21][CH2:22]2)[CH2:15][CH2:16]1.[CH2:46]([Cl:47])[Cl:48].[CH3:49][CH:50]([CH3:51])[O-:52].[CH3:54][CH:55]([CH3:56])[O-:57].[CH3:58][CH:59]([CH3:60])[O-:61].[CH3:62][CH:63]([CH3:64])[O-:65].[CH3:66][OH:67].[Na+:43].[Na+:45].[OH-:44].[Ti+4:53]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]1[C:13](=[O:34])[N:14]([CH:17]2[CH:18]([NH:24][C:25]([O:26][CH2:27][CH2:28][Si:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[CH2:19][CH:20]([NH:39][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:21][CH2:22]2)[CH2:15][CH2:16]1