Acetate → HCID 20323749, compound
Reaction equation
[CH3:1][C:2]1([CH3:26])[O:3][c:4]2[c:5]([c:6]([OH:19])[cH:7][c:8]([CH:10]([CH:11]([CH2:12][CH2:13][CH2:14][CH2:15][CH3:16])[CH3:17])[CH3:18])[cH:9]2)[C:20]2=[C:21]1[CH2:22][CH2:23][NH:24][CH2:25]2.[CH3:31][C:32](=[O:33])[O-:34].[CH3:35][OH:36].[N:27]#[C:28][Br:29].[Na+:30]>>[CH3:1][C:2]1([CH3:26])[O:3][c:4]2[c:5]([c:6]([OH:19])[cH:7][c:8]([CH:10]([CH:11]([CH2:12][CH2:13][CH2:14][CH2:15][CH3:16])[CH3:17])[CH3:18])[cH:9]2)[C:20]2=[C:21]1[CH2:22][CH2:23][N:24]([C:28]#[N:27])[CH2:25]2Participants
6
Sources & evidence
- ORD record
- ord-a49bffdd8d40420d8d4ef74979b9ebb9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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