Acetic Acid → HCID 54229696, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:8]=[C:9]2[C:10](=[O:14])[NH:11][O:12][CH2:13]2)[cH:15][c:16]([C:19]([CH3:20])([CH3:21])[CH3:22])[c:17]1[OH:18].[C:31]([OH:32])(=[O:33])[CH3:34].[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[Cl:23][S:24](=[O:25])(=[O:26])[N:27]=[C:28]=[O:29].[OH2:30]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:8]=[C:9]2[C:10](=[O:14])[N:11]([C:28]([NH2:27])=[O:29])[O:12][CH2:13]2)[cH:15][c:16]([C:19]([CH3:20])([CH3:21])[CH3:22])[c:17]1[OH:18]Participants
7
Sources & evidence
- ORD record
- ord-053177bf94024b2188ba43ecff065a41
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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