HRID1539095

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID67749

Trifluoromethanesulfonic anhydride

C2F6O5S2

HCID98898

2,6-Di-tert-butyl-4-methylpyridine

C14H23N

HCID166653

Hydride

H-

HCID594844

5-phthalimido-1-pentanol

C13H15NO3

HCID178494402

未命名化合物

PRODUCTS

生成物

结构：COC1OC(COCCCCCN2C(=O)c3ccccc3C2=O)CC(OCc2ccccc2)C1OCc1ccccc1

HCID178494400

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3e919188704d480ea7d443c0fa79633e
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

[C:18]([c:19]1[cH:20][c:21]([CH3:22])[cH:23][c:24]([C:25]([CH3:26])([CH3:27])[CH3:28])[n:29]1)([CH3:30])([CH3:31])[CH3:32].[C:1]1(=[O:17])[c:2]2[c:3]([cH:13][cH:14][cH:15][cH:16]2)[C:4](=[O:12])[N:5]1[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][OH:11].[CH2:48]([c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1)[O:55][CH:56]1[CH:57]([O:58][CH3:59])[O:60][CH:61]([CH2:72][OH:73])[CH2:62][CH:63]1[O:64][CH2:65][c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1.[Cl:76][CH2:77][Cl:78].[F:33][C:34]([S:35]([O:36][S:37]([C:38]([F:39])([F:40])[F:41])(=[O:42])=[O:43])(=[O:44])=[O:45])([F:46])[F:47].[H-:74].[Na+:75].[OH2:79]>>[C:1]1(=[O:17])[c:2]2[c:3]([cH:13][cH:14][cH:15][cH:16]2)[C:4](=[O:12])[N:5]1[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][O:11][CH2:72][CH:61]1[O:60][CH:57]([O:58][CH3:59])[CH:56]([O:55][CH2:48][c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[CH:63]([O:64][CH2:65][c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[CH2:62]1