Ethanol → HCID 23513934, compound

HRID 2132891Notes

Reaction equation

HRID 2132891 reaction equation
[CH2:1]([CH:2]=[CH2:3])[O:4][CH2:5][c:6]1[c:7]2[c:8]([C:23]([C:24](=[O:25])[NH:26][C:27]3=[CH:31][C:30](=[O:32])[O:29][CH2:28]3)=[O:33])[cH:9][n:10]([CH2:15][c:16]3[cH:17][cH:18][c:19]([Cl:22])[cH:20][cH:21]3)[c:11]2[cH:12][cH:13][cH:14]1.[CH3:45][OH:46].[CH3:48][CH2:49][CH2:50][CH2:51][CH2:52][CH3:53].[CH3:54][CH2:55][O:56][C:57]([CH3:58])=[O:59].[CH3:65][CH2:66][OH:67].[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[OH2:47].[c:34]1([CH3:35])[cH:36][cH:37][c:38]([S:39]([OH:40])(=[O:41])=[O:42])[cH:43][cH:44]1>>[OH:4][CH2:5][c:6]1[c:7]2[c:8]([C:23]([C:24](=[O:25])[NH:26][C:27]3=[CH:31][C:30](=[O:32])[O:29][CH2:28]3)=[O:33])[cH:9][n:10]([CH2:15][c:16]3[cH:17][cH:18][c:19]([Cl:22])[cH:20][cH:21]3)[c:11]2[cH:12][cH:13][cH:14]1

Participants

9

Reactant 8

HCID 702EthanolHCID 887MethanolHCID 962WaterHCID 6101p-Toluenesulfonic acidHCID 6228DimethylformamideHCID 8058HexaneHCID 8857Ethyl AcetateHCID 23514053HCID 23514053, compound

Product 1

HCID 23513934HCID 23513934, compound

Sources & evidence

ORD record
ord-03adb211003749158ba6fd300f79fbe2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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