Acetic Acid → HCID 58293770, compound
Reaction equation
[C:11]([CH:12]=[O:13])(=[O:14])[O:15][CH2:16][CH3:17].[C:18]([O:19][BH-:20]([O:21][C:22](=[O:23])[CH3:24])[O:25][C:26](=[O:27])[CH3:28])(=[O:29])[CH3:30].[CH2:43]([Cl:44])[Cl:45].[CH3:46][C:47](=[O:48])[OH:49].[Cl:32][C:33](=[O:34])[O:35][CH2:36][CH3:37].[Na+:31].[Na+:42].[O-:38][C:39]([OH:40])=[O:41].[s:1]1[c:2]([CH2:6][CH:7]([CH2:8][CH3:9])[NH2:10])[cH:3][cH:4][cH:5]1>>[s:1]1[c:2]([CH2:6][CH:7]([CH2:8][CH3:9])[N:10]([CH2:12][C:11](=[O:14])[O:15][CH2:16][CH3:17])[C:33](=[O:34])[O:35][CH2:36][CH3:37])[cH:3][cH:4][cH:5]1Participants
9
Sources & evidence
- ORD record
- ord-9548e1b646df42b8b69829ff919d058e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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