HRID1219069

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID241

Benzene

C6H6

HCID311

Citric acid

C6H8O7

HCID962

Water

H2O

HCID8058

n-Hexane

C6H14

HCID8419

Veratraldehyde

C9H10O3

HCID4193578

3,4,5-Trimethoxybenzaldehyde dimethyl acetal

C12H18O5

HCID178418339

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(O)c2c(C(OC)OC)cc(OC)c(OC)c2OC)cc1OC

HCID10597573

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8cdcb7f0ae9e45628f22b3c6beb84fb1
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

[CH2:1]([Li:2])[CH2:3][CH2:4][CH3:5].[CH3:23][O:24][c:25]1[cH:26][cH:27][c:28]([CH:29]=[O:30])[cH:31][c:32]1[O:33][CH3:34].[CH3:48][CH2:49][CH2:50][CH2:51][CH2:52][CH3:53].[CH3:6][O:7][CH:8]([c:9]1[cH:10][c:11]([O:19][CH3:20])[c:12]([O:17][CH3:18])[c:13]([O:15][CH3:16])[cH:14]1)[O:21][CH3:22].[OH2:60].[OH:35][C:36]([CH2:37][C:38]([C:39](=[O:40])[OH:41])([CH2:42][C:43](=[O:44])[OH:45])[OH:46])=[O:47].[cH:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1>>[CH3:6][O:7][CH:8]([c:9]1[c:10]([CH:29]([c:28]2[cH:27][cH:26][c:25]([O:24][CH3:23])[c:32]([O:33][CH3:34])[cH:31]2)[OH:30])[c:11]([O:19][CH3:20])[c:12]([O:17][CH3:18])[c:13]([O:15][CH3:16])[cH:14]1)[O:21][CH3:22]