HRID2144249

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID28123

Tetrahydroborate

H4B-

结构：COc1cc2c(-c3cc4c(C=O)ccnc4n3S(=O)(=O)c3ccc(C)cc3)cn(C)c2cc1OC

HCID86612140

未命名化合物

PRODUCTS

生成物

HCID67147944

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d84e183c594a43448f69610ecda118e8
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

[BH4-:1].[CH3:38][OH:39].[CH3:3][O:4][c:5]1[cH:6][c:7]2[c:8](-[c:17]3[cH:18][c:19]4[c:20]([n:21][cH:22][cH:23][c:24]4[CH:25]=[O:26])[n:27]3[S:28](=[O:29])(=[O:30])[c:31]3[cH:32][cH:33][c:34]([CH3:37])[cH:35][cH:36]3)[cH:9][n:10]([CH3:16])[c:11]2[cH:12][c:13]1[O:14][CH3:15].[CH3:41][CH2:42][O:43][C:44](=[O:45])[CH3:46].[Na+:2].[OH2:40]>>[CH3:3][O:4][c:5]1[cH:6][c:7]2[c:8](-[c:17]3[cH:18][c:19]4[c:20]([n:21][cH:22][cH:23][c:24]4[CH2:25][OH:26])[n:27]3[S:28](=[O:29])(=[O:30])[c:31]3[cH:32][cH:33][c:34]([CH3:37])[cH:35][cH:36]3)[cH:9][n:10]([CH3:16])[c:11]2[cH:12][c:13]1[O:14][CH3:15]