Acetate → HCID 19092704, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][c:7](-[c:10]2[o:11][c:12]3[c:13]([cH:14]2)[cH:15][c:16]([CH:19]=[O:20])[cH:17][cH:18]3)[s:8][cH:9]1.[CH3:25][C:26](=[O:27])[O-:28].[CH3:29][C:30]([O:31][C:32](=[O:33])[CH3:34])=[O:35].[CH3:36][C:37](=[O:38])[OH:39].[ClH:21].[NH2:22][OH:23].[Na+:24].[OH2:40]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][c:7](-[c:10]2[o:11][c:12]3[c:13]([cH:14]2)[cH:15][c:16]([C:19]#[N:22])[cH:17][cH:18]3)[s:8][cH:9]1Participants
9
Sources & evidence
- ORD record
- ord-262cb3e4794c49aaba6b6c6a82ec363e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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