Acetic Acid → HCID 10179531, compound
Reaction equation
[C:32]([O:33][BH-:34]([O:35][C:36](=[O:37])[CH3:38])[O:39][C:40](=[O:41])[CH3:42])(=[O:43])[CH3:44].[CH2:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[CH:26]1[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]1.[CH3:48][C:49](=[O:50])[OH:51].[N:1]1([CH2:7][CH2:8][CH2:9][O:10][c:11]2[cH:12][cH:13][c:14]([CH:15]=[O:16])[cH:17][cH:18]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Na+:45].[Na+:47].[OH-:46]>>[N:1]1([CH2:7][CH2:8][CH2:9][O:10][c:11]2[cH:12][cH:13][c:14]([CH2:15][N:29]3[CH2:28][CH2:27][CH:26]([CH2:19][c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[CH2:31][CH2:30]3)[cH:17][cH:18]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
7
Sources & evidence
- ORD record
- ord-c4534f921f9a4fd4bebef768658342a3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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