Acetate → HCID 67140711, compound
Reaction equation
[CH3:33][C:34](=[O:35])[O-:36].[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH:1]1([CH2:7][S:8](=[O:9])(=[O:10])[N:11]2[C:12](=[O:32])[NH:13][CH:14]([C:16](=[O:17])[N:18]3[CH2:19][CH2:20][N:21]([c:24]4[c:25]([CH3:31])[cH:26][cH:27][c:28]([CH3:30])[cH:29]4)[CH2:22][CH2:23]3)[CH2:15]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cl:53][CH2:54][Cl:55].[c:44]1([B:50]([OH:51])[OH:52])[cH:45][cH:46][cH:47][cH:48][cH:49]1>>[CH:1]1([CH2:7][S:8](=[O:9])(=[O:10])[N:11]2[C:12](=[O:32])[N:13]([c:44]3[cH:45][cH:46][cH:47][cH:48][cH:49]3)[CH:14]([C:16](=[O:17])[N:18]3[CH2:19][CH2:20][N:21]([c:24]4[c:25]([CH3:31])[cH:26][cH:27][c:28]([CH3:30])[cH:29]4)[CH2:22][CH2:23]3)[CH2:15]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
6
Sources & evidence
- ORD record
- ord-d9bcf799652b45a08311de49f8a03c48
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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