Ammonium → HCID 178466630, compound
Reaction equation
[Br:1][c:2]1[c:3]([CH3:11])[cH:4][c:5]([O:8][CH2:9][CH3:10])[cH:6][cH:7]1.[CH2:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[O:19][CH:20]1[C:21]([OH:22])([c:52]2[cH:53][c:54]([CH:59]=[O:60])[c:55]([Cl:58])[cH:56][cH:57]2)[S:23][CH:24]([CH2:43][O:44][CH2:45][c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[CH:25]([O:35][CH2:36][c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[CH:26]1[O:27][CH2:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1.[Cl-:61].[NH4+:62].[O:63]1[CH2:64][CH2:65][CH2:66][CH2:67]1>>[c:2]1([CH:59]([c:54]2[cH:53][c:52]([C:21]3([OH:22])[CH:20]([O:19][CH2:12][c:13]4[cH:14][cH:15][cH:16][cH:17][cH:18]4)[CH:26]([O:27][CH2:28][c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)[CH:25]([O:35][CH2:36][c:37]4[cH:38][cH:39][cH:40][cH:41][cH:42]4)[CH:24]([CH2:43][O:44][CH2:45][c:46]4[cH:47][cH:48][cH:49][cH:50][cH:51]4)[S:23]3)[cH:57][cH:56][c:55]2[Cl:58])[OH:60])[c:3]([CH3:11])[cH:4][c:5]([O:8][CH2:9][CH3:10])[cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-b367333e01454b778008d691fc63800c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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