HRID312253

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID3283

Diethyl Ether

C4H10O

HCID6344

Dichloromethane

CH2Cl2

HCID6356

Boron trifluoride

BF3

结构：CC(=O)OCC1OC(OC(=N)C(Cl)(Cl)Cl)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

HCID5201201

2,3,4,6-Tetra-O-acetyl-1-O-(2,2,2-trichloroethanimidoyl)hexopyranose

C16H20Cl3NO10

结构：O=C(OCc1ccccc1)c1ccc(CCc2coc3cccc(O)c23)cc1

HCID67135888

未命名化合物

PRODUCTS

生成物

结构：CC(=O)OCC1OC(Oc2cccc3occ(CCc4ccc(C(=O)OCc5ccccc5)cc4)c23)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

HCID178476070

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c28c702bdfb04a198ea00d242510759a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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