HRID2317425

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID6331

Borane

H3B

HCID7061

N,N-Diethylaniline

C10H15N

HCID8028

Tetrahydrofuran

C4H8O

HCID139034

未命名化合物

结构：CC(C)c1cc2c(c(-c3ccc(F)cc3)c1C(F)c1ccc(C(F)(F)F)cc1)C(=O)CC1(CCC1)O2

HCID58003046

未命名化合物

PRODUCTS

生成物

HCID178438366

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-bf420d3198764f5e918587337a19cea0
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

[BH3:28].[CH2:17]([N:18]([CH2:19][CH3:20])[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[CH3:27].[CH3:65][OH:66].[F:29][c:30]1[cH:31][cH:32][c:33](-[c:36]2[c:37]3[c:42]([cH:43][c:44]([CH:58]([CH3:59])[CH3:60])[c:45]2[CH:46]([c:47]2[cH:48][cH:49][c:50]([C:53]([F:54])([F:55])[F:56])[cH:51][cH:52]2)[F:57])[O:41][C:40]2([CH2:39][C:38]3=[O:64])[CH2:61][CH2:62][CH2:63]2)[cH:34][cH:35]1.[NH2:1][CH:2]1[c:3]2[c:4]([cH:5][cH:6][cH:7][cH:8]2)[CH2:9][CH:10]1[OH:11].[O:12]1[CH2:13][CH2:14][CH2:15][CH2:16]1>>[F:29][c:30]1[cH:31][cH:32][c:33](-[c:36]2[c:37]3[c:42]([cH:43][c:44]([CH:58]([CH3:59])[CH3:60])[c:45]2[CH:46]([c:47]2[cH:48][cH:49][c:50]([C:53]([F:54])([F:55])[F:56])[cH:51][cH:52]2)[F:57])[O:41][C:40]2([CH2:39][CH:38]3[OH:64])[CH2:61][CH2:62][CH2:63]2)[cH:34][cH:35]1