Acetic Acid → HCID 18001025, compound
Reaction equation
[C:29]([BH3-:30])#[N:31].[CH2:27]=[O:28].[CH3:33][C:34](=[O:35])[OH:36].[CH3:37][OH:38].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[N:1]1([c:7]2[cH:8][c:9]([Cl:26])[c:10]([C:11](=[O:12])[N:13]3[CH2:14][CH2:15][CH2:16][CH2:17][c:18]4[c:19]3[cH:20][cH:21][cH:22][cH:23]4)[cH:24][cH:25]2)[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1.[Na+:32]>>[N:1]1([c:7]2[cH:8][c:9]([Cl:26])[c:10]([C:11](=[O:12])[N:13]3[CH2:14][CH2:15][CH2:16][CH2:17][c:18]4[c:19]3[cH:20][cH:21][cH:22][cH:23]4)[cH:24][cH:25]2)[CH2:2][CH2:3][N:4]([CH3:29])[CH2:5][CH2:6]1Participants
8
Sources & evidence
- ORD record
- ord-02e56ef26df14671b705d8b0ea960e97
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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