HRID1227127

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID1118

Sulfuric acid

H2O4S

HCID1140

Toluene

C7H8

HCID6342

Acetonitrile

C2H3N

HCID37153

1,10-Decanediol

C10H22O2

结构：OC1(Cl)OC(COCc2ccccc2)C(OCc2ccccc2)C(OCc2ccccc2)C1OCc1ccccc1

HCID178516697

未命名化合物

PRODUCTS

生成物

结构：OCCCCCCCCCCOC1OC(COCc2ccccc2)C(OCc2ccccc2)C(OCc2ccccc2)C1OCc1ccccc1

HCID178520599

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0bbea3f807284f6683725c8b77a34785
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

[C:66](#[N:67])[CH3:68].[CH2:42]([CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][OH:52])[OH:53].[CH3:69][CH2:70][OH:71].[Cl:1][C:2]1([OH:3])[CH:4]([O:5][CH2:6][c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[CH:13]([O:14][CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[CH:22]([O:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[CH:31]([CH2:33][O:34][CH2:35][c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[O:32]1.[S:54](=[O:55])(=[O:56])([OH:57])[OH:58].[c:59]1([CH3:60])[cH:61][cH:62][cH:63][cH:64][cH:65]1>>[CH:2]1([O:53][CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][OH:52])[CH:4]([O:5][CH2:6][c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[CH:13]([O:14][CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[CH:22]([O:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[CH:31]([CH2:33][O:34][CH2:35][c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[O:32]1