Ethanol → HCID 20239378, compound

HRID 318757Notes

Reaction equation

HRID 318757 reaction equation
[CH3:28][NH2:29].[CH3:30][CH2:31][OH:32].[CH3:33][OH:34].[OH:1][CH2:2][CH:3]1[CH2:4][S:5][CH:6]([CH:21]2[CH:22]=[CH:23][CH:24]=[CH:25][C:26]2=[NH:27])[N:7]2[CH:8]1[c:9]1[cH:10][c:11]([O:19][CH3:20])[c:12]([O:17][CH3:18])[cH:13][c:14]1[CH2:15][CH2:16]2>>[OH:1][CH2:2][CH:3]1[CH2:4][S:5][CH:6]([CH:21]=[NH:29])[N:7]2[CH:8]1[c:9]1[cH:10][c:11]([O:19][CH3:20])[c:12]([O:17][CH3:18])[cH:13][c:14]1[CH2:15][CH2:16]2

Participants

5

Sources & evidence

ORD record
ord-29e5b82f3d7040fc856ca6fe8020962e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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