Acetone → HCID 13175971, compound
Reaction equation
[C:26](=[O:27])([OH:28])[O-:29].[CH3:40][C:41](=[O:42])[CH3:43].[NH2:1][CH:2]1[CH:3]2[S:4][CH2:5][C:6]([c:14]3[cH:15][n:16][c:17](-[c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)[s:18]3)=[C:7]([C:11](=[O:12])[OH:13])[N:8]2[C:9]1=[O:10].[Na+:30].[OH2:25].[s:31]1[c:32]([CH2:36][C:37](=[O:38])[Cl:39])[cH:33][cH:34][cH:35]1>>[NH:1]([CH:2]1[CH:3]2[S:4][CH2:5][C:6]([c:14]3[cH:15][n:16][c:17](-[c:19]4[cH:20][cH:21][cH:22][cH:23][cH:24]4)[s:18]3)=[C:7]([C:11](=[O:12])[OH:13])[N:8]2[C:9]1=[O:10])[C:37]([CH2:36][c:32]1[s:31][cH:35][cH:34][cH:33]1)=[O:38]Participants
7
Sources & evidence
- ORD record
- ord-a87c53cd10684e86abd760129545ee8c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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