Ethanol → HCID 22262332, compound

HRID 2343696Notes

Reaction equation

HRID 2343696 reaction equation
[CH3:31][CH2:32][OH:33].[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[CH:9]([CH2:14][c:15]3[cH:16][c:17]([O:22][C:23]([CH:24]([F:25])[F:26])([F:27])[F:28])[cH:18][c:19]([CH3:21])[cH:20]3)[NH:10][C:11](=[O:13])[O:12]2)[cH:6][cH:7]1.[Na+:30].[OH-:29]>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH:9]([NH2:10])[CH2:14][c:15]2[cH:16][c:17]([O:22][C:23]([CH:24]([F:25])[F:26])([F:27])[F:28])[cH:18][c:19]([CH3:21])[cH:20]2)[OH:12])[cH:6][cH:7]1

Participants

5

Sources & evidence

ORD record
ord-471ffeeb959a46aeb224d867814de9a1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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