Acetic Acid → HCID 25225544, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][CH2:5][CH2:6][CH2:7][S:8](=[O:9])(=[O:10])[O:11][CH2:12][C:13]([CH:14]([C:15](=[O:16])[O:17][CH2:18][CH2:19][O:20][C:21](=[O:22])[O:23][CH2:24][CH3:25])[O:26][CH2:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)([CH3:34])[CH3:35].[CH3:54][C:55](=[O:56])[OH:57].[CH3:58][OH:59].[Cl:36][S:37]([CH2:38][CH2:39][CH2:40][N:41]1[C:42](=[O:43])[c:44]2[cH:45][cH:46][cH:47][cH:48][c:49]2[C:50]1=[O:51])(=[O:52])=[O:53]>>[C:1]([CH3:2])(=[O:3])[NH:4][CH2:5][CH2:6][CH2:7][S:8](=[O:9])(=[O:10])[O:11][CH2:12][C:13]([CH:14]([C:15](=[O:16])[O:17][CH2:18][CH2:19][O:20][C:21](=[O:22])[O:23][CH2:24][CH3:25])[OH:26])([CH3:34])[CH3:35]Participants
5
Sources & evidence
- ORD record
- ord-d88914c87aac4f7eae87bc13ec6ccfd3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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