Acetic Acid → HCID 178471347, compound
Reaction equation
[C:55]([BH3-:56])#[N:57].[CH2:26]([c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[O:33][C:34](=[O:35])[N:36]1[CH2:37][CH2:38][CH:39]([CH2:42][CH2:43][CH2:44][CH2:45][CH2:46][CH2:47][C:48]([C:49](=[O:50])[O:51][CH2:52][CH3:53])=[O:54])[CH2:40][CH2:41]1.[CH3:22][C:23](=[O:24])[OH:25].[CH3:59][CH2:60][OH:61].[NH2:1][CH:2]1[CH2:3][O:4][c:5]2[c:6]([cH:18][cH:19][cH:20][cH:21]2)[N:7]([CH2:10][C:11](=[O:12])[O:13][C:14]([CH3:15])([CH3:16])[CH3:17])[C:8]1=[O:9].[Na+:58]>>[NH:1]([CH:2]1[CH2:3][O:4][c:5]2[c:6]([cH:18][cH:19][cH:20][cH:21]2)[N:7]([CH2:10][C:11](=[O:12])[O:13][C:14]([CH3:15])([CH3:16])[CH3:17])[C:8]1=[O:9])[CH:48]([CH2:47][CH2:46][CH2:45][CH2:44][CH2:43][CH2:42][CH:39]1[CH2:38][CH2:37][N:36]([C:34]([O:33][CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)=[O:35])[CH2:41][CH2:40]1)[C:49](=[O:50])[O:51][CH2:52][CH3:53]Participants
7
Sources & evidence
- ORD record
- ord-60533af555a346ef88a06067f03b8cd6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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