HRID947487

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID10931

3,3-Dimethylacrylic acid

C5H8O2

结构：O=C(c1ccccc1)c1ccc(OCC(O)COc2ccc(C(=O)c3ccccc3)c(O)c2)cc1O

HCID1242235

[4-[3-(4-benzoyl-3-hydroxyphenoxy)-2-hydroxypropoxy]-2-hydroxyphenyl]-phenylmethanone

C29H24O7

PRODUCTS

生成物

结构：CC(C)=CC(=O)OC(COc1ccc(C(=O)c2ccccc2)c(O)c1)COc1ccc(C(=O)c2ccccc2)c(O)c1

HCID54279358

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-966be12191d8417bb88dc13701e97bea
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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