Ammonium → HCID 178519708, compound
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([O:8][CH:9]2[CH2:10][CH2:11][O:12][CH2:13][CH2:14]2)[cH:6][cH:7]1.[CH2:15]([c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1)[O:22][CH:23]1[C:24]([OH:25])([c:55]2[cH:56][c:57]([CH:61]=[O:62])[cH:58][cH:59][cH:60]2)[S:26][CH:27]([CH2:46][O:47][CH2:48][c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[CH:28]([O:38][CH2:39][c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[CH:29]1[O:30][CH2:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[Cl-:63].[NH4+:64].[O:65]1[CH2:66][CH2:67][CH2:68][CH2:69]1>>[c:2]1([CH:61]([c:57]2[cH:56][c:55]([C:24]3([OH:25])[CH:23]([O:22][CH2:15][c:16]4[cH:17][cH:18][cH:19][cH:20][cH:21]4)[CH:29]([O:30][CH2:31][c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)[CH:28]([O:38][CH2:39][c:40]4[cH:41][cH:42][cH:43][cH:44][cH:45]4)[CH:27]([CH2:46][O:47][CH2:48][c:49]4[cH:50][cH:51][cH:52][cH:53][cH:54]4)[S:26]3)[cH:60][cH:59][cH:58]2)[OH:62])[cH:3][cH:4][c:5]([O:8][CH:9]2[CH2:10][CH2:11][O:12][CH2:13][CH2:14]2)[cH:6][cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-dba3e2afe8fb4b6390f03369efd059ac
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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