HRID2141459

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID6212

Chloroform

CHCl3

HCID2724942

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)NC1CCN(CCn2c(=O)ccc3ncc(F)cc32)CC1O

HCID178452866

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7b82886ee2154903abff120df6484454
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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