Ammonium → 3,4,5-Trihydroxy-6-{2-methyl-2-[3-(3-{4-[7-(2-morpholin-4-yl-ethoxy)-benzo[d]imidazo[2,1-b]thiazol-2-yl]-phenyl}-ureido)-isoxazol-5-yl]-propoxy}-tetrahydro-pyran-2-carboxylic acid
Reaction equation
[CH3:56][S:57](=[O:58])[CH3:59].[F:43][CH:44]1[CH:45]([OH:46])[CH:47]([OH:48])[CH:49]([OH:50])[CH:51]([C:53](=[O:54])[OH:55])[O:52]1.[NH4+:42].[Na+:65].[Na+:66].[Na+:67].[OH:1][CH2:2][C:3]([CH3:4])([CH3:5])[c:6]1[cH:7][c:8]([NH:11][C:12](=[O:13])[NH:14][c:15]2[cH:16][cH:17][c:18](-[c:21]3[n:22][c:23]4[s:24][c:25]5[c:26]([n:27]4[cH:28]3)[cH:29][cH:30][c:31]([O:33][CH2:34][CH2:35][N:36]3[CH2:37][CH2:38][O:39][CH2:40][CH2:41]3)[cH:32]5)[cH:19][cH:20]2)[n:9][o:10]1.[P:60]([O-:61])([O-:62])([O-:63])=[O:64]>>[O:1]([CH2:2][C:3]([CH3:4])([CH3:5])[c:6]1[cH:7][c:8]([NH:11][C:12](=[O:13])[NH:14][c:15]2[cH:16][cH:17][c:18](-[c:21]3[n:22][c:23]4[s:24][c:25]5[c:26]([n:27]4[cH:28]3)[cH:29][cH:30][c:31]([O:33][CH2:34][CH2:35][N:36]3[CH2:37][CH2:38][O:39][CH2:40][CH2:41]3)[cH:32]5)[cH:19][cH:20]2)[n:9][o:10]1)[CH:44]1[CH:45]([OH:46])[CH:47]([OH:48])[CH:49]([OH:50])[CH:51]([C:53](=[O:54])[OH:55])[O:52]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-01aaaba545024b45942c175d6b29bba3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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