Carbon Dioxide → HCID 20080504, compound
Reaction equation
[CH2:36]([O:37][CH2:38][CH3:39])[CH3:40].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[n:10][c:11]([CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH:27]([C:28]([OH:29])=[O:30])[C:31]#[N:32])[o:12][c:13]2-[c:14]2[cH:15][cH:16][c:17]([O:20][CH3:21])[cH:18][cH:19]2)[cH:7][cH:8]1.[O:33]=[C:34]=[O:35]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[n:10][c:11]([CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][C:31]#[N:32])[o:12][c:13]2-[c:14]2[cH:15][cH:16][c:17]([O:20][CH3:21])[cH:18][cH:19]2)[cH:7][cH:8]1Participants
4
Sources & evidence
- ORD record
- ord-1eea6988bc02482c8e7f98292dd7c543
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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