Ethanol → HCID 22099855, compound

HRID 2346374Notes

Reaction equation

HRID 2346374 reaction equation
[CH3:28][CH2:29][OH:30].[Na+:32].[OH-:31].[OH2:27].[c:1]1(-[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:2]([C:7](=[O:8])[NH:9][c:10]2[cH:11][c:12]([Cl:20])[c:13]([C:14](=[O:15])[O:16][CH3:17])[cH:18][cH:19]2)[cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:2]([C:7](=[O:8])[NH:9][c:10]2[cH:11][c:12]([Cl:20])[c:13]([C:14](=[O:15])[OH:16])[cH:18][cH:19]2)[cH:3][cH:4][cH:5][cH:6]1

Participants

6

Sources & evidence

ORD record
ord-ea5f32cf56394b58ace653273d6c9af7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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