HRID288297

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID8078

Cyclohexane

C6H12

HCID8857

Ethyl acetate

C4H8O2

HCID62406

未命名化合物

HCID316905

Allyl 2,2,2-Trichloroacetimidate

C5H6Cl3NO

结构：CCC1C=C(C)CC(C)CC(OC)C2OC(O)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C)=CC3CCC(O)C(OC)C3)C(C)CCC1=O)C(C)CC2OC

HCID57262833

未命名化合物

PRODUCTS

生成物

结构：C=CCOC1CCC(C=C(C)C2OC(=O)C3CCCCN3C(=O)C(=O)C3(O)OC(C(OC)CC(C)CC(C)=CC(CC)C(=O)CCC2C)C(OC)CC3C)CC1OC

HCID57109548

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-213831b29911486fb136b63d891970a7
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

[CH2:1]([CH3:2])[CH:3]1[C:4](=[O:55])[CH2:5][CH2:6][CH:7]([CH3:54])[CH:8]([C:42](=[CH:43][CH:44]2[CH2:45][CH:46]([O:51][CH3:52])[CH:47]([OH:50])[CH2:48][CH2:49]2)[CH3:53])[O:9][C:10](=[O:41])[CH:11]2[CH2:12][CH2:13][CH2:14][CH2:15][N:16]2[C:17](=[O:40])[C:18](=[O:39])[C:19]2([OH:38])[CH:20]([CH3:37])[CH2:21][CH:22]([O:35][CH3:36])[CH:23]([CH:24]([O:32][CH3:33])[CH2:25][CH:26]([CH3:31])[CH2:27][C:28]([CH3:30])=[CH:29]1)[O:34]2.[CH2:74]([Cl:75])[Cl:76].[CH2:77]1[CH2:78][CH2:79][CH2:80][CH2:81][CH2:82]1.[CH3:83][CH2:84][O:85][C:86](=[O:87])[CH3:88].[Cl:56][C:57]([Cl:58])([Cl:59])[C:63](=[NH:64])[O:65][CH2:60][CH:61]=[CH2:62].[OH:66][S:67]([C:68]([F:69])([F:70])[F:71])(=[O:72])=[O:73]>>[CH2:1]([CH3:2])[CH:3]1[C:4](=[O:55])[CH2:5][CH2:6][CH:7]([CH3:54])[CH:8]([C:42](=[CH:43][CH:44]2[CH2:45][CH:46]([O:51][CH3:52])[CH:47]([O:50][CH2:62][CH:61]=[CH2:60])[CH2:48][CH2:49]2)[CH3:53])[O:9][C:10](=[O:41])[CH:11]2[CH2:12][CH2:13][CH2:14][CH2:15][N:16]2[C:17](=[O:40])[C:18](=[O:39])[C:19]2([OH:38])[CH:20]([CH3:37])[CH2:21][CH:22]([O:35][CH3:36])[CH:23]([CH:24]([O:32][CH3:33])[CH2:25][CH:26]([CH3:31])[CH2:27][C:28]([CH3:30])=[CH:29]1)[O:34]2