Acetic Acid → HCID 77559342, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:11])[OH:12])[CH2:13][S:14][CH2:15][c:16]1[cH:17][cH:18][c:19]([NH:22][C:23]([CH2:24][n:25]2[cH:26][cH:27][c:28]3[cH:29][c:30]([F:34])[cH:31][cH:32][c:33]23)=[O:35])[cH:20][cH:21]1.[CH3:36][OH:37].[CH3:38][C:39](=[O:40])[OH:41].[CH3:45][CH2:46][O:47][C:48](=[O:49])[CH3:50].[Cl:42][CH2:43][Cl:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:11])[OH:12])[CH2:13][S:14]([CH2:15][c:16]1[cH:17][cH:18][c:19]([NH:22][C:23]([CH2:24][n:25]2[cH:26][cH:27][c:28]3[cH:29][c:30]([F:34])[cH:31][cH:32][c:33]23)=[O:35])[cH:20][cH:21]1)=[O:37]Participants
6
Sources & evidence
- ORD record
- ord-c31cf381354a4acda83dbd16cec56c4a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…