Trifluoroacetic acid → 4-(3-Hydroxyoctyl)-2,5-dioxo-1,3,4-thiadiazoline-3-heptanoic acid
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]=[CH:8][CH2:9][CH2:10][CH2:11][CH2:12][n:13]1[c:14](=[O:28])[s:15][c:16](=[O:27])[n:17]1[CH2:18][CH2:19][CH:20]([CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])[OH:26])=[O:29].[OH:30][C:31]([C:32]([F:33])([F:34])[F:35])=[O:36]>>[O:5]=[C:6]([CH:7]=[CH:8][CH2:9][CH2:10][CH2:11][CH2:12][n:13]1[c:14](=[O:28])[s:15][c:16](=[O:27])[n:17]1[CH2:18][CH2:19][CH:20]([CH2:21][CH2:22][CH2:23][CH2:24][CH3:25])[OH:26])[OH:29]Participants
3
Sources & evidence
- ORD record
- ord-cfd0c17345f64161bbc01b966eab0c79
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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