Acetic Acid → HCID 58654417, compound
Reaction equation
[C:1]([BH3-:2])#[N:3].[CH3:47][C:48](=[O:49])[OH:50].[CH:51]([O:52][CH3:53])([O:54][CH3:55])[O:56][CH3:57].[Na+:4].[O:26]1[CH2:27][O:28][c:29]2[c:30]1[cH:31][cH:32][c:33]([CH2:35][N:36]([C:37]([O:38][C:39]([CH3:40])([CH3:41])[CH3:42])=[O:43])[CH2:44][CH:45]=[O:46])[cH:34]2.[OH2:58].[n:5]1(-[c:10]2[n:11][c:12]([CH3:25])[cH:13][c:14]([CH:16]3[NH:17][CH2:18][CH2:19][CH:20]3[C:21](=[O:22])[NH:23][CH3:24])[n:15]2)[cH:6][n:7][cH:8][cH:9]1>>[n:5]1(-[c:10]2[n:11][c:12]([CH3:25])[cH:13][c:14]([CH:16]3[N:17]([CH2:45][CH2:44][N:36]([CH2:35][c:33]4[cH:32][cH:31][c:30]5[c:29]([cH:34]4)[O:28][CH2:27][O:26]5)[C:37]([O:38][C:39]([CH3:40])([CH3:41])[CH3:42])=[O:43])[CH2:18][CH2:19][CH:20]3[C:21](=[O:22])[NH:23][CH3:24])[n:15]2)[cH:6][n:7][cH:8][cH:9]1Participants
8
Sources & evidence
- ORD record
- ord-0c20b44e4bc74e4aa20136496a161326
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
Loading…