Ammonium → HCID 178481336, compound
Reaction equation
[C:29]([CH3:30])([CH3:31])([CH3:32])[O:33][C:34](=[O:35])[NH:36][CH:37]1[CH2:38][N:39]([c:43]2[c:44]([C:64](=[O:65])[OH:66])[c:45]3[n:46]([CH3:63])[c:47](=[O:62])[n:48]([CH3:61])[c:49](=[O:60])[c:50]3[n:51]2[CH2:52][c:53]2[c:54]([Cl:59])[cH:55][cH:56][cH:57][cH:58]2)[CH2:40][CH2:41][CH2:42]1.[CH2:23]1[CH2:24][O:25][CH2:26][CH2:27][NH:28]1.[CH3:12][N:13]([CH3:14])[CH2:15][CH2:16][CH2:17][N:18]=[C:19]=[N:20][CH2:21][CH3:22].[CH3:69][N:70]([CH3:71])[CH:72]=[O:73].[CH3:74][CH2:75][N:76]([CH2:77][CH3:78])[CH2:79][CH3:80].[Cl-:67].[ClH:11].[NH4+:68].[OH:1][n:2]1[c:3]2[cH:4][cH:5][cH:6][cH:7][c:8]2[n:9][n:10]1>>[CH2:23]1[CH2:24][O:25][CH2:26][CH2:27][N:28]1[C:64]([c:44]1[c:43]([N:39]2[CH2:38][CH:37]([NH:36][C:34]([O:33][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:35])[CH2:42][CH2:41][CH2:40]2)[n:51]([CH2:52][c:53]2[c:54]([Cl:59])[cH:55][cH:56][cH:57][cH:58]2)[c:50]2[c:45]1[n:46]([CH3:63])[c:47](=[O:62])[n:48]([CH3:61])[c:49]2=[O:60])=[O:65]Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-cd217f521b1b4e5982aa6a6e9492d128
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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