HRID193020

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID5237175

tert-Butyl 3-(hydroxymethyl)pyrrolidine-1-carboxylate

C10H19NO3

结构：CCCCc1nnc(Cl)cc1-c1ccc(OCc2ccccc2)cc1

HCID71303089

未命名化合物

PRODUCTS

生成物

结构：CCCCc1nnc(OCC2CCN(C(=O)OC(C)(C)C)C2)cc1-c1ccc(OCc2ccccc2)cc1

HCID67374710

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-666f6005495b401595fca5aa76cb12f3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH2:13][OH:14])[CH2:11][CH2:12]1.[CH2:17]([c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)[O:24][c:25]1[cH:26][cH:27][c:28](-[c:31]2[c:32]([CH2:38][CH2:39][CH2:40][CH3:41])[n:33][n:34][c:35]([Cl:37])[cH:36]2)[cH:29][cH:30]1.[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[H-:16].[Na+:15].[OH2:42]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH2:13][O:14][c:35]2[n:34][n:33][c:32]([CH2:38][CH2:39][CH2:40][CH3:41])[c:31](-[c:28]3[cH:27][cH:26][c:25]([O:24][CH2:17][c:18]4[cH:19][cH:20][cH:21][cH:22][cH:23]4)[cH:30][cH:29]3)[cH:36]2)[CH2:11][CH2:12]1