Acetic Acid → HCID 178518449, compound
Reaction equation
[C:34]([O:35][BH-:36]([O:37][C:38](=[O:39])[CH3:40])[O:41][C:42](=[O:43])[CH3:44])(=[O:45])[CH3:46].[CH3:48][C:49](=[O:50])[OH:51].[CH3:52][N:53]([CH3:54])[CH:55]=[O:56].[NH2:1][CH2:2][CH:3]([CH2:4][O:5][c:6]1[cH:7][n:8][cH:9][cH:10][cH:11]1)[OH:12].[Na+:47].[O:13]=[C:14]1[CH2:15][CH2:16][N:17]([c:20]2[cH:21][cH:22][c:23]([CH2:24][CH:25]3[C:26](=[O:31])[NH:27][C:28](=[O:30])[S:29]3)[cH:32][cH:33]2)[CH2:18][CH2:19]1>>[NH:1]([CH2:2][CH:3]([CH2:4][O:5][c:6]1[cH:7][n:8][cH:9][cH:10][cH:11]1)[OH:12])[CH:14]1[CH2:15][CH2:16][N:17]([c:20]2[cH:21][cH:22][c:23]([CH2:24][CH:25]3[C:26](=[O:31])[NH:27][C:28](=[O:30])[S:29]3)[cH:32][cH:33]2)[CH2:18][CH2:19]1Participants
7
Sources & evidence
- ORD record
- ord-444d35700a6948a4b406f20fc2840c9e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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