HRID802711

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID6344

Dichloromethane

CH2Cl2

HCID24823

Ozone

HCID31215

Triethyl phosphite

C6H15O3P

HCID643471

Benzyl 2,5-dihydro-1H-pyrrole-1-carboxylate

C12H13NO2

HCID2724942

未命名化合物

结构：CC(C)(C)c1ccc(-c2nc3cncc(N)c3[nH]2)cc1

HCID178440764

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)c1ccc(-c2nc3c(N4CCN(C(=O)OCc5ccccc5)CC4)cncc3[nH]2)cc1

HCID57832760

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a86c9c359404491eb0bbff2d4b333294
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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