Ethanol → HCID 19700371, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[c:11]1[cH:12][c:13]([NH:17][C:18]([NH:19][CH2:20][C:21](=[O:22])[N:23]2[CH:24]([C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[CH2:25][CH:26]([S:35](=[O:36])(=[O:37])[CH3:38])[CH:27]2[c:28]2[c:29]([F:34])[cH:30][cH:31][cH:32][cH:33]2)=[O:46])[cH:14][cH:15][cH:16]1.[CH3:47][CH2:48][OH:49]>>[O:8]=[C:9]([OH:10])[c:11]1[cH:12][c:13]([NH:17][C:18]([NH:19][CH2:20][C:21](=[O:22])[N:23]2[CH:24]([C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[CH2:25][CH:26]([S:35](=[O:36])(=[O:37])[CH3:38])[CH:27]2[c:28]2[c:29]([F:34])[cH:30][cH:31][cH:32][cH:33]2)=[O:46])[cH:14][cH:15][cH:16]1Participants
3
Sources & evidence
- ORD record
- ord-5fd7e75e9ffc4965a2ae83ebab61e3b1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…