HRID93627

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID8028

Tetrahydrofuran

C4H8O

HCID8471

Triethylamine

C6H15N

HCID14917

Hydrogen fluoride

3 次

结构：CC(C)(C)[Si](C)(C)OC(CNCCc1ccc(Oc2cccc(-c3ccccc3)c2)cc1)c1ccc(OCc2ccccc2)c2[nH]c(=O)ccc12

HCID178455262

未命名化合物

PRODUCTS

生成物

结构：O=c1ccc2c(C(O)CNCCc3ccc(Oc4cccc(-c5ccccc5)c4)cc3)ccc(OCc3ccccc3)c2[nH]1

HCID178515706

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-47861df494a144d0bf6cf4e7dc0f47cd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([CH:20]([CH2:21][NH:22][CH2:23][CH2:24][c:25]2[cH:26][cH:27][c:28]([O:31][c:32]3[cH:33][c:34](-[c:38]4[cH:39][cH:40][cH:41][cH:42][cH:43]4)[cH:35][cH:36][cH:37]3)[cH:29][cH:30]2)[O:44][Si:45]([C:46]([CH3:47])([CH3:48])[CH3:49])([CH3:50])[CH3:51])[c:13]2[cH:14][cH:15][c:16](=[O:19])[nH:17][c:18]12.[CH2:55]([N:56]([CH2:57][CH3:58])[CH2:59][CH3:60])[CH3:61].[FH:52].[FH:53].[FH:54].[Na+:68].[O:62]1[CH2:63][CH2:64][CH2:65][CH2:66]1.[OH-:67]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([CH:20]([CH2:21][NH:22][CH2:23][CH2:24][c:25]2[cH:26][cH:27][c:28]([O:31][c:32]3[cH:33][c:34](-[c:38]4[cH:39][cH:40][cH:41][cH:42][cH:43]4)[cH:35][cH:36][cH:37]3)[cH:29][cH:30]2)[OH:44])[c:13]2[cH:14][cH:15][c:16](=[O:19])[nH:17][c:18]12