HRID1542197

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID3283

Diethyl Ether

C4H10O

HCID6344

Dichloromethane

CH2Cl2

HCID6356

Boron trifluoride

BF3

HCID12052

Silane, triethyl-

C6H16Si

结构：OC1(c2cc(Cc3cc4cc(F)ccc4s3)cc3ccccc23)OC(COCc2ccccc2)C(OCc2ccccc2)C(OCc2ccccc2)C1OCc1ccccc1

HCID178514917

未命名化合物

PRODUCTS

生成物

结构：Fc1ccc2sc(Cc3cc(C4OC(COCc5ccccc5)C(OCc5ccccc5)C(OCc5ccccc5)C4OCc4ccccc4)c4ccccc4c3)cc2c1

HCID178505482

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a5b7244b46a74d1da27107536718426c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[B:13]([F:14])([F:15])[F:16].[C:78](=[O:79])([O-:80])[OH:81].[CH2:17]([c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)[O:24][CH:25]1[C:26]([OH:56])([c:57]2[cH:58][c:59]([CH2:67][c:68]3[cH:69][c:70]4[c:71]([s:72]3)[cH:73][cH:74][c:75]([F:77])[cH:76]4)[cH:60][c:61]3[cH:62][cH:63][cH:64][cH:65][c:66]23)[O:27][CH:28]([CH2:47][O:48][CH2:49][c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[CH:29]([O:39][CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[CH:30]1[O:31][CH2:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[CH2:1]([SiH:2]([CH2:3][CH3:4])[CH2:5][CH3:6])[CH3:7].[CH2:83]([Cl:84])[Cl:85].[CH2:8]([O:9][CH2:10][CH3:11])[CH3:12].[Na+:82]>>[CH2:17]([c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)[O:24][CH:25]1[CH:26]([c:57]2[cH:58][c:59]([CH2:67][c:68]3[cH:69][c:70]4[c:71]([s:72]3)[cH:73][cH:74][c:75]([F:77])[cH:76]4)[cH:60][c:61]3[cH:62][cH:63][cH:64][cH:65][c:66]23)[O:27][CH:28]([CH2:47][O:48][CH2:49][c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[CH:29]([O:39][CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[CH:30]1[O:31][CH2:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1