Hydrochloric Acid → HCID 22237691, compound
Reaction equation
[CH2:31]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[O:38][c:39]1[cH:40][cH:41][c:42]([CH2:43][O:44][CH2:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][NH2:51])[cH:52][cH:53]1.[CH3:54][CH2:55][N:56]([CH2:57][CH3:58])[CH2:59][CH3:60].[Cl:66][CH2:67][Cl:68].[ClH:61].[F:1][C:2]([c:3]1[cH:4][c:5](-[c:9]2[cH:10][c:11]([C:12](=[O:13])[OH:14])[cH:15][c:16](-[c:19]3[cH:20][c:21]([C:25]([F:26])([F:27])[F:28])[cH:22][cH:23][cH:24]3)[c:17]2[OH:18])[cH:6][cH:7][cH:8]1)([F:29])[F:30].[S:62]([Cl:63])([Cl:64])=[O:65]>>[F:1][C:2]([c:3]1[cH:4][c:5](-[c:9]2[cH:10][c:11]([C:12](=[O:13])[NH:51][CH2:50][CH2:49][CH2:48][CH2:47][CH2:46][CH2:45][O:44][CH2:43][c:42]3[cH:41][cH:40][c:39]([O:38][CH2:31][c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[cH:53][cH:52]3)[cH:15][c:16](-[c:19]3[cH:20][c:21]([C:25]([F:26])([F:27])[F:28])[cH:22][cH:23][cH:24]3)[c:17]2[OH:18])[cH:6][cH:7][cH:8]1)([F:29])[F:30]Participants
7
Sources & evidence
- ORD record
- ord-574df7f9464d40a385927b1920faa07d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…