Acetic Acid → HCID 59447060, compound
Reaction equation
[C:30]([CH3:31])([CH3:32])([CH3:33])[O:34][C:35]([CH2:36][NH2:37])=[O:38].[C:46]([O:47][BH-:48]([O:49][C:50](=[O:51])[CH3:52])[O:53][C:54](=[O:55])[CH3:56])(=[O:57])[CH3:58].[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:60][C:61](=[O:62])[OH:63].[CH:1]1([N:7]([c:8]2[cH:9][c:10]([C:14](=[O:15])[NH:16][c:17]3[cH:18][cH:19][c:20]([CH:23]=[O:24])[cH:21][cH:22]3)[n:11][cH:12][n:13]2)[CH2:25][CH:26]2[CH2:27][CH2:28]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cl:64][CH2:65][Cl:66].[ClH:29].[Na+:59]>>[CH:1]1([N:7]([c:8]2[cH:9][c:10]([C:14](=[O:15])[NH:16][c:17]3[cH:18][cH:19][c:20]([CH2:23][NH:37][CH2:36][C:35]([O:34][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:38])[cH:21][cH:22]3)[n:11][cH:12][n:13]2)[CH2:25][CH:26]2[CH2:27][CH2:28]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-4ae95c6014f2420881424d266ffd4248
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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