Trifluoroacetic acid → alpha-[6-(1-Butoxycarbonyl-3-phenylpropylamino)-5-oxo-2-(2-thienyl)perhydro-1,4-thiazepin-4-yl]acetic acid
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[CH:8]([CH2:9][CH2:10][c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[NH:17][CH:18]1[C:19](=[O:38])[N:20]([CH2:30][C:31](=[O:32])[O:33][C:34]([CH3:35])([CH3:36])[CH3:37])[CH2:21][CH:22]([c:25]2[s:26][cH:27][cH:28][cH:29]2)[S:23][CH2:24]1.[OH:39][C:40]([C:41]([F:42])([F:43])[F:44])=[O:45]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6](=[O:7])[CH:8]([CH2:9][CH2:10][c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[NH:17][CH:18]1[C:19](=[O:38])[N:20]([CH2:30][C:31](=[O:32])[OH:33])[CH2:21][CH:22]([c:25]2[s:26][cH:27][cH:28][cH:29]2)[S:23][CH2:24]1Participants
3
Sources & evidence
- ORD record
- ord-3ee9e448017d4fafb5162087ac229ec9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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