Acetaldehyde → HCID 178463928, compound
Reaction equation
[C:38]([BH3-:39])#[N:40].[CH3:42][OH:43].[CH:1]([CH3:2])([CH3:3])[NH:4][CH:5]1[CH2:6][CH:7]([CH2:28][S:29](=[O:30])(=[O:31])[CH:32]([CH3:33])[CH3:34])[CH:8]([N:11]2[C:12](=[O:27])[CH:13]=[C:14]([c:17]3[cH:18][c:19]([C:23]([F:24])([F:25])[F:26])[cH:20][cH:21][cH:22]3)[CH2:15][CH2:16]2)[CH2:9][CH2:10]1.[CH:35]([CH3:36])=[O:37].[Na+:41]>>[CH:1]([CH3:2])([CH3:3])[N:4]([CH:5]1[CH2:6][CH:7]([CH2:28][S:29](=[O:30])(=[O:31])[CH:32]([CH3:33])[CH3:34])[CH:8]([N:11]2[C:12](=[O:27])[CH:13]=[C:14]([c:17]3[cH:18][c:19]([C:23]([F:24])([F:25])[F:26])[cH:20][cH:21][cH:22]3)[CH2:15][CH2:16]2)[CH2:9][CH2:10]1)[CH2:35][CH3:36]Participants
6
Sources & evidence
- ORD record
- ord-355b65fbb3304275aba34d0b64e74f06
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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