HRID1204744

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID679

Dimethyl sulfoxide

C2H6OS

HCID923

Sodium ion

Na+

HCID166653

Hydride

H-

HCID10976401

1-Propanol, 3-[(4-methoxyphenyl)methoxy]-

C11H16O3

反应SMILES：Oc1nc2ncnn2c(C2CCCCCC2)c1-c1c(F)cc(F)cc1F

HCID178517386

未命名化合物

PRODUCTS

产物

反应SMILES：COc1ccc(COCCCOc2cc(F)c(-c3c(O)nc4ncnn4c3C3CCCCCC3)c(F)c2)cc1

HCID178491462

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-c949589755cb43cc927adab6e69b7fbd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应SMILES

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