Ethanol → HCID 54171740, compound
Reaction equation
[CH2:1]([CH3:2])[c:3]1[n:4][c:5]2[c:6]([n:7]1[CH2:8][c:9]1[cH:10][cH:11][c:12](-[c:15]3[c:16]([C:21](=[O:22])[O:23][CH3:24])[cH:17][cH:18][cH:19][cH:20]3)[cH:13][cH:14]1)[cH:25][c:26]([NH:30][C:31](=[N:32][S:33](=[O:34])(=[O:35])[CH3:36])[N:37]([CH3:38])[CH3:39])[cH:27][c:28]2[CH3:29].[CH3:42][CH2:43][OH:44].[Na+:41].[OH-:40]>>[CH2:1]([CH3:2])[c:3]1[n:4][c:5]2[c:6]([n:7]1[CH2:8][c:9]1[cH:10][cH:11][c:12](-[c:15]3[c:16]([C:21](=[O:22])[OH:23])[cH:17][cH:18][cH:19][cH:20]3)[cH:13][cH:14]1)[cH:25][c:26]([NH:30][C:31](=[N:32][S:33](=[O:34])(=[O:35])[CH3:36])[N:37]([CH3:38])[CH3:39])[cH:27][c:28]2[CH3:29]Participants
5
Sources & evidence
- ORD record
- ord-e62ab9d1daf440f9a634e1a94460b409
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…