Ammonium → Tert-butyl 3-[[3,3-dimethyl-1-oxo-1-(1-phenylethylamino)butan-2-yl]carbamoyl]-6-(3-methyl-4-phenoxyphenyl)hexanoate

HRID 2343693Notes

Reaction equation

HRID 2343693 reaction equation
[CH3:1][C:2]([CH:3]([C:4](=[O:5])[NH:6][CH:7]([CH3:8])[c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[NH:15][C:16](=[O:17])[CH:18]([CH2:19][C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:27][CH:28]=[CH:29][c:30]1[cH:31][c:32]([CH3:43])[c:33]([O:36][c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[cH:34][cH:35]1)([CH3:44])[CH3:45].[CH3:50][OH:51].[CH:46]([O-:47])=[O:48].[NH4+:49]>>[CH3:1][C:2]([CH:3]([C:4](=[O:5])[NH:6][CH:7]([CH3:8])[c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[NH:15][C:16](=[O:17])[CH:18]([CH2:19][C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:27][CH2:28][CH2:29][c:30]1[cH:31][c:32]([CH3:43])[c:33]([O:36][c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[cH:34][cH:35]1)([CH3:44])[CH3:45]

Participants

5

Reactant 4

HCID 223AmmoniumHCID 283FormateHCID 887MethanolHCID 178424948HCID 178424948, compound

Product 1

HCID 22950117Tert-butyl 3-[[3,3-dimethyl-1-oxo-1-(1-phenylethylamino)butan-2-yl]carbamoyl]-6-(3-methyl-4-phenoxyphenyl)hexanoate

Sources & evidence

ORD record
ord-de39ec8ac69d4c93a22c0f3b187d2178
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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