HRID681218

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID263

1-Butanol

C4H10O

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID5281

Octadecanoic acid

C18H36O2

HCID6395

Methanesulfonic acid

CH4O3S

HCID15953

Methanesulfonic acid, butyl ester

C5H12O3S

HCID31278

Butyl octadecanoate

C22H44O2

PRODUCTS

产物

HCID813

Potassium cation

K+

HCID3033836

Octadecanoate

C18H35O2-

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-fdde00794e414fa0baf19565e89d35fe
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]([CH2:2][CH2:3][CH2:4][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][CH3:18])(=[O:19])[O:20][CH2:21][CH2:22][CH2:23][CH3:24].[CH2:61]([OH:62])[CH2:63][CH2:64][CH3:65].[CH3:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][C:42](=[O:43])[OH:44].[CH3:45][S:46]([O:47][CH2:48][CH2:49][CH2:50][CH3:51])(=[O:52])=[O:53].[CH3:56][S:57](=[O:58])(=[O:59])[OH:60].[K+:55].[OH-:54]>>[C:1]([CH2:2][CH2:3][CH2:4][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][CH3:18])(=[O:19])[O-:20].[K+:55]