Acetic Acid → HCID 178422482, compound
Reaction equation
[C:34]([BH3-:35])#[N:36].[C:38]([OH:39])(=[O:40])[CH3:41].[CH3:17][c:18]1[n:19][c:20]2[cH:21][cH:22][c:23]3[c:24]([c:25]2[cH:26][cH:27]1)[O:28][CH:29]([CH2:32][NH2:33])[CH2:30][O:31]3.[CH3:42][OH:43].[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([c:7]3[c:8]([o:9]2)[CH2:10][CH2:11][CH:12]([CH:14]=[O:15])[CH2:13]3)[cH:16]1.[Na+:37]>>[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([c:7]3[c:8]([o:9]2)[CH2:10][CH2:11][CH:12]([CH2:14][NH:33][CH2:32][CH:29]2[O:28][c:24]4[c:23]([cH:22][cH:21][c:20]5[n:19][c:18]([CH3:17])[cH:27][cH:26][c:25]54)[O:31][CH2:30]2)[CH2:13]3)[cH:16]1Participants
7
Sources & evidence
- ORD record
- ord-384ae57b34c14cd19fe84e6da3ba8b12
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…