Acetic Acid → HCID 15702727, compound
Reaction equation
[C:1](=[O:2])([OH:3])[CH:4]([C:5](=[CH2:6])[CH3:7])[N:8]1[C:9](=[O:34])[CH:10]([NH:24][C:25]([CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)=[O:33])[CH:11]1[S:12][N:13]1[C:14](=[O:23])[c:15]2[c:16]([cH:19][cH:20][cH:21][cH:22]2)[C:17]1=[O:18].[CH3:38][C:39](=[O:40])[OH:41].[CH3:47][CH2:48][O:49][CH2:50][CH3:51].[N+:35](=[N-:36])=[CH2:37].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1>>[C:1]([O:2][CH3:37])(=[O:3])[CH:4]([C:5](=[CH2:6])[CH3:7])[N:8]1[C:9](=[O:34])[CH:10]([NH:24][C:25]([CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)=[O:33])[CH:11]1[S:12][N:13]1[C:14](=[O:23])[c:15]2[c:16]([cH:19][cH:20][cH:21][cH:22]2)[C:17]1=[O:18]Participants
6
Sources & evidence
- ORD record
- ord-81e1f309c18f4c18aa1454ce8ae2f00d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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