Ethanol → HCID 77287058, compound

HRID 1237779Notes

Reaction equation

HRID 1237779 reaction equation
[C:10]([CH3:11])([CH3:12])([CH3:13])[O:14][C:15](=[O:16])[N:17]1[CH2:18][CH2:19][C:20]2([CH2:21][N:22]([CH:24]3[CH2:25][CH2:26][c:27]4[cH:28][c:29](-[c:33]5[cH:34][n:35][c:36]([C:39]#[N:40])[cH:37][cH:38]5)[cH:30][cH:31][c:32]43)[CH2:23]2)[CH2:41][CH2:42]1.[CH3:43][CH2:44][OH:45].[NH2:4][C:5](=[O:6])[NH2:7].[Na+:9].[OH-:8].[OH2:1].[OH:2][OH:3]>>[C:5](=[O:6])([NH2:7])[c:36]1[n:35][cH:34][c:33](-[c:29]2[cH:28][c:27]3[c:32]([cH:31][cH:30]2)[CH:24]([N:22]2[CH2:21][C:20]4([CH2:19][CH2:18][N:17]([C:15]([O:14][C:10]([CH3:11])([CH3:12])[CH3:13])=[O:16])[CH2:42][CH2:41]4)[CH2:23]2)[CH2:25][CH2:26]3)[cH:38][cH:37]1

Participants

8

Reactant 7

HCID 702EthanolHCID 784Hydrogen PeroxideHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 1176UreaHCID 77286678HCID 77286678, compound

Product 1

HCID 77287058HCID 77287058, compound

Sources & evidence

ORD record
ord-441db64165254a7fa3ab20f7ee74a5ad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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