Acetic Acid → HCID 58345784, compound
Reaction equation
[C:38]([BH3-:39])#[N:40].[CH2:1]([CH2:2][CH3:3])[N:4]([CH2:5][CH2:6][CH2:7][CH2:8][NH:9][C:10](=[O:11])[NH:12][c:13]1[cH:14][cH:15][c:16]([CH2:19][NH:20][CH2:21][c:22]2[nH:23][cH:24][cH:25][n:26]2)[cH:17][cH:18]1)[CH2:27][CH2:28][CH3:29].[CH3:30][n:31]1[c:32]([CH:36]=[O:37])[n:33][cH:34][cH:35]1.[CH3:42][C:43](=[O:44])[OH:45].[CH3:46][OH:47].[Na+:41]>>[CH2:1]([CH2:2][CH3:3])[N:4]([CH2:5][CH2:6][CH2:7][CH2:8][NH:9][C:10](=[O:11])[NH:12][c:13]1[cH:14][cH:15][c:16]([CH2:19][N:20]([CH2:21][c:22]2[n:23][cH:24][cH:25][nH:26]2)[CH2:36][c:32]2[n:31]([CH3:30])[cH:35][cH:34][n:33]2)[cH:17][cH:18]1)[CH2:27][CH2:28][CH3:29]Participants
7
Sources & evidence
- ORD record
- ord-e918d611aa19412e913d3b816cc7f95d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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