3-[N-(2,2,5,5-Tetramethyl-1,3-dioxane-4-carbonyl)amino]propionic acid → HCID 53930264, compound
Reaction equation
[CH3:26][C:27]1([CH3:43])[O:28][CH2:29][C:30]([CH3:41])([CH3:42])[CH:31]([C:33](=[O:34])[NH:35][CH2:36][CH2:37][C:38](=[O:39])[OH:40])[O:32]1.[NH2:1][CH2:2][CH2:3][CH2:4][CH2:5][NH:6][C:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH:15]=[CH:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH3:24])=[O:25]>>[NH:1]([CH2:2][CH2:3][CH2:4][CH2:5][NH:6][C:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH:15]=[CH:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH3:24])=[O:25])[C:38]([CH2:37][CH2:36][NH:35][C:33]([CH:31]1[C:30]([CH3:41])([CH3:42])[CH2:29][O:28][C:27]([CH3:26])([CH3:43])[O:32]1)=[O:34])=[O:39]Participants
3
Sources & evidence
- ORD record
- ord-1df0ea479c144c4dba1a6cff8c659ea7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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