HRID2335155

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

5 次

HCID961

Hydroxide

HO-

HCID6344

Dichloromethane

CH2Cl2

HCID28123

Tetrahydroborate

H4B-

4 次

结构：COc1cc2c(cc1OC)CC(=O)N(CCC(=N)N(C)CC1Cc3cc(OC)c(OC)cc31)CC2

HCID67533445

未命名化合物

PRODUCTS

生成物

结构：COc1cc2c(cc1OC)CC(=O)N(CCCN(C)CC1Cc3cc(OC)c(OC)cc31)CC2

HCID6426711

3-(3-{[(3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl)methyl](methyl)amino}propyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2H-3-benzazepin-2-one

C27H36N2O5

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7f6c2492bb71478d9db6c7186604706d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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