HRID88887

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID311

Citric Acid

C6H8O7

HCID679

Dimethyl sulfoxide

C2H6OS

HCID1049

Pyridine

C5H5N

HCID8857

Ethyl acetate

C4H8O2

HCID24682

Sulfur trioxide

O3S

HCID81531

Diisopropylethylamine

C8H19N

结构：C=C(C)CCC(CC=CC1CCC(O)C1CCSc1nc(C(=O)OCC)cs1)O[Si](C)(C)C(C)(C)C

HCID77223287

未命名化合物

PRODUCTS

生成物

HCID77256852

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5a7de056fabc4f63a61abce2315dde67
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:1][C:2]([CH3:3])([CH3:4])[Si:5]([O:6][CH:7]([CH2:8][CH:9]=[CH:10][CH:11]1[CH:12]([CH2:17][CH2:18][S:19][c:20]2[s:21][cH:22][c:23]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[n:24]2)[CH:13]([OH:16])[CH2:14][CH2:15]1)[CH2:30][CH2:31][C:32](=[CH2:33])[CH3:34])([CH3:35])[CH3:36].[CH3:69][CH2:70][O:71][C:72](=[O:73])[CH3:74].[CH3:75][S:76](=[O:77])[CH3:78].[CH:37]([N:38]([CH:39]([CH3:40])[CH3:41])[CH2:42][CH3:43])([CH3:44])[CH3:45].[OH:56][C:57]([CH2:58][C:59]([C:60](=[O:61])[OH:62])([CH2:63][C:64](=[O:65])[OH:66])[OH:67])=[O:68].[S:52](=[O:53])(=[O:54])=[O:55].[n:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1>>[CH3:1][C:2]([CH3:3])([CH3:4])[Si:5]([O:6][CH:7]([CH2:8][CH:9]=[CH:10][CH:11]1[CH:12]([CH2:17][CH2:18][S:19][c:20]2[s:21][cH:22][c:23]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[n:24]2)[C:13](=[O:16])[CH2:14][CH2:15]1)[CH2:30][CH2:31][C:32](=[CH2:33])[CH3:34])([CH3:35])[CH3:36]