Ammonium → HCID 87605732, compound
Reaction equation
[CH2:84]1[O:85][CH2:86][CH2:87][CH2:88]1.[CH3:1][c:2]1[c:3]([O:4][CH:5]([CH2:6][OH:7])[CH2:8][c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][c:17]([C:19]([C:20]([F:21])([F:22])[F:23])([C:24]([F:25])([F:26])[F:27])[O:28][CH2:29][c:30]2[cH:31][cH:32][c:33]([O:36][CH3:37])[cH:34][cH:35]2)[cH:18]1.[CH3:38][O:39][C:40]([CH2:41][CH2:42][c:43]1[cH:44][cH:45][c:46]([OH:49])[cH:47][cH:48]1)=[O:50].[Cl-:82].[NH4+:83].[O:70]=[C:71]([O:72][CH2:73][CH3:74])[N:75]=[N:76][C:77]([O:78][CH2:79][CH3:80])=[O:81].[c:51]1([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[cH:65][cH:66][cH:67][cH:68][cH:69]1>>[CH3:1][c:2]1[c:3]([O:4][CH:5]([CH2:6][O:7][c:46]2[cH:45][cH:44][c:43]([CH2:42][CH2:41][C:40]([O:39][CH3:38])=[O:50])[cH:48][cH:47]2)[CH2:8][c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][c:17]([C:19]([C:20]([F:21])([F:22])[F:23])([C:24]([F:25])([F:26])[F:27])[O:28][CH2:29][c:30]2[cH:31][cH:32][c:33]([O:36][CH3:37])[cH:34][cH:35]2)[cH:18]1Participants
8
Sources & evidence
- ORD record
- ord-98d27eb4912a4397bb1b70dbbd995f08
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…