Ethanol → HCID 67438983, compound

HRID 1560222Notes

Reaction equation

HRID 1560222 reaction equation
[CH3:37][CH2:38][OH:39].[H:35][H:36].[O:1]1[CH2:2][CH2:3][C:4]([c:7]2[cH:8][c:9]3[c:10]([c:11]([F:13])[cH:12]2)[O:14][c:15]2[cH:16][cH:17][c:18](-[c:28]4[c:29]([F:34])[n:30][cH:31][cH:32][cH:33]4)[cH:19][c:20]2[C:21]32[CH2:22][O:23][CH2:24][C:25]([NH2:27])=[N:26]2)=[CH:5][CH2:6]1>>[O:1]1[CH2:2][CH2:3][CH:4]([c:7]2[cH:8][c:9]3[c:10]([c:11]([F:13])[cH:12]2)[O:14][c:15]2[cH:16][cH:17][c:18](-[c:28]4[c:29]([F:34])[n:30][cH:31][cH:32][cH:33]4)[cH:19][c:20]2[C:21]32[CH2:22][O:23][CH2:24][C:25]([NH2:27])=[N:26]2)[CH2:5][CH2:6]1

Participants

4

Reactant 3

HCID 702EthanolHCID 53390580HCID 53390580, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 67438983HCID 67438983, compound

Sources & evidence

ORD record
ord-d4ada2d017694e85aa1caf6de1f10006
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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