Acetic Acid → HCID 13173178, compound
Reaction equation
[BH4-:26].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7](-[c:16]2[n:17][c:18]3[n:22]([c:23]2[CH:24]=[O:25])[CH2:21][CH2:20][S:19]3)[cH:8][c:9]([C:12]([CH3:13])([CH3:14])[CH3:15])[c:10]1[OH:11].[CH3:28][C:29](=[O:30])[OH:31].[CH3:33][CH2:34][OH:35].[Na+:27].[OH2:32]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7](-[c:16]2[n:17][c:18]3[n:22]([c:23]2[CH2:24][OH:25])[CH2:21][CH2:20][S:19]3)[cH:8][c:9]([C:12]([CH3:13])([CH3:14])[CH3:15])[c:10]1[OH:11]Participants
7
Sources & evidence
- ORD record
- ord-f8bce8a0dd9f46989da83f5029ac5bd2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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