HRID1130943

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID36336

1,4,7,10,13-Pentaoxacyclopentadecane

C10H20O5

HCID166653

Hydride

H-

HCID735900

1-Boc-4-piperidone

C10H17NO3

结构：CCOP(=O)(Cc1cccc(Oc2ccc(C(F)(F)F)cc2)c1)OCC

HCID86623903

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(=Cc2cccc(Oc3ccc(C(F)(F)F)cc3)c2)CC1

HCID86623904

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d2398e5c99ba46c6b840820b91c8102f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[C:44]([CH3:45])([CH3:46])([CH3:47])[O:48][C:49](=[O:50])[N:51]1[CH2:52][CH2:53][C:54](=[O:57])[CH2:55][CH2:56]1.[CH2:27]1[O:28][CH2:29][CH2:30][O:31][CH2:32][CH2:33][O:34][CH2:35][CH2:36][O:37][CH2:38][CH2:39][O:40][CH2:41]1.[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([O:7][c:8]2[cH:9][c:10]([CH2:11][P:12](=[O:13])([O:14][CH2:15][CH3:16])[O:17][CH2:18][CH3:19])[cH:20][cH:21][cH:22]2)[cH:23][cH:24]1)([F:25])[F:26].[H-:42].[Na+:43].[OH2:63]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([O:7][c:8]2[cH:9][c:10]([CH:11]=[C:54]3[CH2:53][CH2:52][N:51]([C:49]([O:48][C:44]([CH3:45])([CH3:46])[CH3:47])=[O:50])[CH2:56][CH2:55]3)[cH:20][cH:21][cH:22]2)[cH:23][cH:24]1)([F:25])[F:26]