Ammonium → ethyl 6-[[3-amino-5-methyl-4-[3-[5-[N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]-2-methylsulfanylthiophen-3-yl]sulfonylphenyl]phenyl]carbamoylamino]hexanoate
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][NH:10][C:11](=[O:12])[NH:13][c:14]1[cH:15][c:16]([N+:47]([O-:48])=[O:49])[c:17](-[c:21]2[cH:22][c:23]([S:27](=[O:28])(=[O:29])[c:30]3[c:31]([S:45][CH3:46])[s:32][c:33]([C:35](=[NH:36])[NH:37][C:38](=[O:39])[O:40][C:41]([CH3:42])([CH3:43])[CH3:44])[cH:34]3)[cH:24][cH:25][cH:26]2)[c:18]([CH3:20])[cH:19]1)=[O:50].[CH3:53][CH2:54][OH:55].[Cl-:51].[NH4+:52]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][NH:10][C:11](=[O:12])[NH:13][c:14]1[cH:15][c:16]([NH2:47])[c:17](-[c:21]2[cH:22][c:23]([S:27](=[O:28])(=[O:29])[c:30]3[c:31]([S:45][CH3:46])[s:32][c:33]([C:35](=[NH:36])[NH:37][C:38](=[O:39])[O:40][C:41]([CH3:42])([CH3:43])[CH3:44])[cH:34]3)[cH:24][cH:25][cH:26]2)[c:18]([CH3:20])[cH:19]1)=[O:50]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-0f083ccbef6742d88526cae6671322ea
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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