HRID2318901

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID12679

Hexamethylphosphoramide

C6H18N3OP

HCID92127

3-Iodo-1,2-propanediol

C3H7IO2

HCID20475772

未命名化合物

PRODUCTS

生成物

结构：O=C(OCC(O)CO)c1ccc(NCCCCCCCCC2CCCCC2)cc1

HCID20475812

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cc01205483bf453797221bc294feed81
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

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