HRID1561880

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID222

Ammonia gas

H3N

HCID769

Bicarbonate Ion

CHO3-

HCID813

Potassium cation

K+

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

2 次

HCID9845

Trifluoroacetic anhydride

C4F6O3

HCID14284

N,N-Dimethylpyridin-4-amine

C7H10N2

HCID24401

Permanganate Ion

MnO4-

HCID69867

Indole-3-carboxylic acid

C9H7NO2

HCID57894407

未命名化合物

PRODUCTS

生成物

结构：COC(=O)CN1C2CC(OC(=O)c3c[nH]c4ccccc34)CC1CC(C(=O)OC)C2

HCID57693707

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3b433cdb8d32447288cbde6854c35351
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:57](=[O:58])([OH:59])[O-:60].[CH3:26][O:27][C:28](=[O:29])[CH:30]1[CH2:31][CH:32]2[CH2:33][CH:34]([OH:44])[CH2:35][CH:36]([CH2:37]1)[N:38]2[CH2:39][C:40](=[O:41])[O:42][CH3:43].[CH3:46][OH:47].[CH3:65][N:66]([c:67]1[cH:68][cH:69][n:70][cH:71][cH:72]1)[CH3:73].[Cl:48][CH2:49][Cl:50].[Cl:62][CH2:63][Cl:64].[F:13][C:14]([F:15])([F:16])[C:17]([O:18][C:19](=[O:20])[C:21]([F:22])([F:23])[F:24])=[O:25].[K+:56].[Mn:51]([O-:52])(=[O:53])(=[O:54])=[O:55].[NH3:45].[Na+:61].[OH2:74].[OH:1][C:2](=[O:3])[c:4]1[cH:5][nH:6][c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]12>>[O:1]=[C:2]([O:3][CH:34]1[CH2:33][CH:32]2[CH2:31][CH:30]([C:28]([O:27][CH3:26])=[O:29])[CH2:37][CH:36]([CH2:35]1)[N:38]2[CH2:39][C:40](=[O:41])[O:42][CH3:43])[c:4]1[cH:5][nH:6][c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]12