Butanal → HCID 178448792, compound
Reaction equation
[BH4-:29].[CH:36]([CH2:37][CH2:38][CH3:39])=[O:40].[NH2:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[nH:9][c:10](-[c:21]3[cH:22][cH:23][c:24]([O:27][CH3:28])[cH:25][cH:26]3)[c:11]([C:13](=[O:14])[NH:15][c:16]3[s:17][cH:18][cH:19][n:20]3)[n:12]2)[cH:6][cH:7]1.[Na+:30].[S:31](=[O:32])(=[O:33])([OH:34])[OH:35]>>[NH:1]([c:2]1[cH:3][cH:4][c:5](-[c:8]2[nH:9][c:10](-[c:21]3[cH:22][cH:23][c:24]([O:27][CH3:28])[cH:25][cH:26]3)[c:11]([C:13](=[O:14])[NH:15][c:16]3[s:17][cH:18][cH:19][n:20]3)[n:12]2)[cH:6][cH:7]1)[CH2:36][CH2:37][CH2:38][CH3:39]Participants
6
Sources & evidence
- ORD record
- ord-69e7e18c02f24dc8b67bb67f9a95ee20
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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