Acetic Acid → HCID 58958187, compound
Reaction equation
[C:37]([OH:38])(=[O:39])[CH3:40].[CH2:27]1[NH:28][CH2:29][CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][c:36]21.[CH3:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10]([NH:12][c:13]2[cH:14][c:15](-[c:19]3[c:20]([CH:25]=[O:26])[cH:21][cH:22][cH:23][cH:24]3)[cH:16][cH:17][cH:18]2)[cH:11]1.[Cl:41][CH:42]([Cl:43])[CH3:44]>>[CH3:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2[c:10]([NH:12][c:13]2[cH:14][c:15](-[c:19]3[c:20]([CH2:25][N:28]4[CH2:27][c:36]5[c:31]([cH:32][cH:33][cH:34][cH:35]5)[CH2:30][CH2:29]4)[cH:21][cH:22][cH:23][cH:24]3)[cH:16][cH:17][cH:18]2)[cH:11]1Participants
5
Sources & evidence
- ORD record
- ord-515b83d4eccd465c88c9391e35278769
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
- DOI