Acetate → HCID 178474791, compound
Reaction equation
[CH3:30][C:31](=[O:32])[O:33][C:34](=[O:35])[CH3:36].[CH3:38][C:39](=[O:40])[O-:41].[Cl:1][c:2]1[cH:3][c:4]2[c:5]3[cH:6][cH:7][n:8][cH:9][c:10]3[nH:11][c:12]2[c:13]([NH:15][C:16](=[O:17])[CH:18]2[CH2:19][O:20][C:21]([CH3:28])([CH3:29])[CH2:22][N:23]2[CH2:24][CH:25]([CH3:26])[NH2:27])[cH:14]1.[NH4+:37]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]3[cH:6][cH:7][n:8][cH:9][c:10]3[nH:11][c:12]2[c:13]([NH:15][C:16](=[O:17])[CH:18]2[CH2:19][O:20][C:21]([CH3:28])([CH3:29])[CH2:22][N:23]2[CH2:24][CH:25]([CH3:26])[NH:27][C:31]([CH3:30])=[O:32])[cH:14]1Participants
5
Sources & evidence
- ORD record
- ord-a61ff96368e849b4936705ed48f3ef74
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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