Acetic Acid → HCID 22258967, compound
Reaction equation
[C:52]([BH3-:53])#[N:54].[CH3:40][C:41](=[O:42])[OH:43].[CH3:56][OH:57].[CH:44](=[O:45])[c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[NH2:1][c:2]1[n:3][c:4](-[c:23]2[c:24]([NH2:39])[cH:25][cH:26][cH:27][c:28]2[O:29][CH2:30][c:31]2[cH:32][cH:33][c:34]([O:37][CH3:38])[cH:35][cH:36]2)[cH:5][c:6]([CH:10]2[CH2:11][N:12]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:13][CH2:14][CH2:15]2)[c:7]1[C:8]#[N:9].[Na+:55]>>[NH2:1][c:2]1[n:3][c:4](-[c:23]2[c:24]([NH:39][CH2:44][c:46]3[cH:47][cH:48][cH:49][cH:50][cH:51]3)[cH:25][cH:26][cH:27][c:28]2[O:29][CH2:30][c:31]2[cH:32][cH:33][c:34]([O:37][CH3:38])[cH:35][cH:36]2)[cH:5][c:6]([CH:10]2[CH2:11][N:12]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:13][CH2:14][CH2:15]2)[c:7]1[C:8]#[N:9]Participants
7
Sources & evidence
- ORD record
- ord-5e093a7b65c6439b825eb6c2321ef44f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…