HRID1134855

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID769

Bicarbonate Ion

CHO3-

HCID813

Potassium cation

K+

HCID8857

Ethyl acetate

C4H8O2

结构：CC(=O)OCC(O[Si](C)(C)C)=C1C(C)CC2C3CCC4=CC(=O)C=CC4(C)C3=CCC12C

HCID76045737

未命名化合物

PRODUCTS

生成物

结构：CC(=O)OCC(=O)C1C(C)CC2C3CCC4=CC(=O)C=CC4(C)C3=CCC21C

HCID14585237

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2e8739c0bec746d4b3e169824e5018a6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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