Acetic Acid → HCID 23070638, compound
Reaction equation
[CH2:11]([C:12]#[C:13][CH3:14])[n:15]1[c:16]([N:26]2[CH2:27][CH2:28][N:29]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:30][CH2:31]2)[n:17][c:18]([CH:24]=[O:25])[c:19]1[C:20](=[O:21])[O:22][CH3:23].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[CH3:4][C:5](=[O:6])[OH:7].[CH3:8][C:9]#[N:10].[Na:1][C:2]#[N:3]>>[C:2](#[N:3])[CH:24]([c:18]1[n:17][c:16]([N:26]2[CH2:27][CH2:28][N:29]([C:32](=[O:33])[O:34][C:35]([CH3:36])([CH3:37])[CH3:38])[CH2:30][CH2:31]2)[n:15]([CH2:11][C:12]#[C:13][CH3:14])[c:19]1[C:20](=[O:21])[O:22][CH3:23])[OH:25]Participants
6
Sources & evidence
- ORD record
- ord-91701e0da2dc4255bb79c0d51ca57b66
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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