Acetate → HCID 178471243, compound
Reaction equation
[C:1]([OH:2])(=[O:3])[C:4]([OH:5])=[O:6].[C:7]([CH3:8])([CH3:9])([CH3:10])[O:11][C:12]([CH2:13][N:14]([CH:15]1[CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]2[CH2:23]1)[C:24]([CH:25]([NH2:26])[CH3:27])=[O:28])=[O:29].[CH3:31][C:32](=[O:33])[O-:34].[CH3:35][C:36](=[O:37])[OH:38].[CH3:54][CH2:55][OH:56].[Na+:30].[O:39]=[C:40]([C:41](=[O:42])[O:43][CH2:44][CH3:45])[CH2:46][CH2:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1>>[C:7]([CH3:8])([CH3:9])([CH3:10])[O:11][C:12]([CH2:13][N:14]([CH:15]1[CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][c:22]2[CH2:23]1)[C:24]([CH:25]([NH:26][CH:40]([C:41](=[O:42])[O:43][CH2:44][CH3:45])[CH2:46][CH2:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1)[CH3:27])=[O:28])=[O:29]Participants
8
Sources & evidence
- ORD record
- ord-61a40f0668fe41bab8263a1cbb84883b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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