HRID685774

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID12393

Hexadecyl acetate

C18H36O2

HCID178443786

未命名化合物

PRODUCTS

产物

HCID2682

Cetyl Alcohol

C16H34O

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-189806da0a1d489cb61053d45243782f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

[C:1](=[O:2])([CH3:3])[O:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH3:20].[C:24]([C:25]([NH3+:26])([C:27](=[O:28])[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH3:35])[C:36](=[O:37])[CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH3:44])(=[O:45])[CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH3:52].[Cl-:23].[Na+:22].[OH-:21].[OH2:53]>>[OH:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH3:20]