Acetate → HCID 178447077, compound
Reaction equation
[CH3:53][C:54](=[O:55])[O-:56].[Cl:1][C:2]([Cl:3])([Cl:50])[CH2:51][O:4][C:5](=[O:6])[CH:7]1[NH:8][N:9]([C:13]([CH:14]([CH2:15][c:16]2[cH:17][c:18]([O:22][Si:23]([CH3:24])([CH3:25])[C:26]([CH3:27])([CH3:28])[CH3:29])[cH:19][cH:20][cH:21]2)[NH:30][C:31]([CH:32]([CH:33]([CH3:34])[CH3:35])[NH:36][C:37]([CH:38]([CH:39]([CH2:40][CH2:41][CH:42]=[CH2:43])[O:44][CH3:45])[CH3:46])=[O:47])=[O:48])=[O:49])[CH2:10][CH2:11][CH2:12]1.[NH4+:52].[O:57]1[CH2:58][CH2:59][CH2:60][CH2:61]1.[OH2:62].[Zn:63]>>[O:4]=[C:5]([OH:6])[CH:7]1[NH:8][N:9]([C:13]([CH:14]([CH2:15][c:16]2[cH:17][c:18]([O:22][Si:23]([CH3:24])([CH3:25])[C:26]([CH3:27])([CH3:28])[CH3:29])[cH:19][cH:20][cH:21]2)[NH:30][C:31]([CH:32]([CH:33]([CH3:34])[CH3:35])[NH:36][C:37]([CH:38]([CH:39]([CH2:40][CH2:41][CH:42]=[CH2:43])[O:44][CH3:45])[CH3:46])=[O:47])=[O:48])=[O:49])[CH2:10][CH2:11][CH2:12]1Participants
7
Sources & evidence
- ORD record
- ord-7d73d9faa1fb4c98b71e74c11c1368ed
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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