Acetic Acid → HCID 21923035, compound
Reaction equation
[C:31]([BH3-:32])#[N:33].[CH3:29][OH:30].[CH3:35][CH2:36][O:37][C:38]([CH3:39])=[O:40].[CH3:41][C:42](=[O:43])[OH:44].[Cl:20][c:21]1[cH:22][cH:23][c:24]([CH:25]=[O:26])[cH:27][cH:28]1.[NH2:1][CH2:2][CH2:3][NH:4][c:5]1[c:6]2[n:7][cH:8][n:9]([CH:15]3[CH2:16][CH2:17][CH2:18][CH2:19]3)[c:10]2[n:11][c:12]([Cl:14])[n:13]1.[Na+:34]>>[NH:1]([CH2:2][CH2:3][NH:4][c:5]1[c:6]2[n:7][cH:8][n:9]([CH:15]3[CH2:16][CH2:17][CH2:18][CH2:19]3)[c:10]2[n:11][c:12]([Cl:14])[n:13]1)[CH2:25][c:24]1[cH:23][cH:22][c:21]([Cl:20])[cH:28][cH:27]1Participants
8
Sources & evidence
- ORD record
- ord-ab71e1407f1c47869d15400ac10e983e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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