HRID206078

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID753

Glycerol

C3H8O3

HCID962

Water

H2O

HCID1140

Toluene

C7H8

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID12586

1,3-Dioxolane

C3H6O2

HCID69423

Nonadecan-2-one

C19H38O

PRODUCTS

生成物

HCID14373938

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-edaa47cbea71417ba6f474f4a3291c05
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

[CH3:1][C: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][CH2:18][CH3:19])=[O:20].[CH3:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1.[O:38]1[CH2:39][CH2:40][O:41][CH2:42]1.[OH2:50].[OH:21][CH2:22][CH:23]([OH:24])[CH2:25][OH:26].[c:27]1([CH3:28])[cH:29][cH:30][c:31]([S:32]([OH:33])(=[O:34])=[O:35])[cH:36][cH:37]1>>[CH3:1][C:2]1([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][CH2:18][CH3:19])[O:20][CH2:25][CH:23]([CH2:22][OH:21])[O:24]1