Ethanol → HCID 54390534, compound

HRID 303520Notes

Reaction equation

HRID 303520 reaction equation
[CH3:29][CH2:30][OH:31].[H:27][H:28].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([cH:26]1)[CH2:9][N:10]1[CH:11]([CH2:12][N:13]2[C:14]([CH2:15][CH2:16][N:17]2[CH2:18][CH2:19][CH2:20][CH2:21]2)=[O:22])[CH2:23][CH2:24][CH2:25]1>>[NH2:1][c:4]1[cH:5][cH:6][c:7]2[c:8]([cH:26]1)[CH2:9][N:10]1[CH:11]([CH2:12][N:13]2[C:14]([CH2:15][CH2:16][N:17]2[CH2:18][CH2:19][CH2:20][CH2:21]2)=[O:22])[CH2:23][CH2:24][CH2:25]1

Participants

4

Sources & evidence

ORD record
ord-c8f62efb2ee54db3b38ef2cbbbcd5a4b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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