1,4-Dioxane → HCID 59371230, compound
Reaction equation
[CH:37]([N:38]([CH:39]([CH3:40])[CH3:41])[CH2:42][CH3:43])([CH3:44])[CH3:45].[F:27][c:28]1[n:29][cH:30][c:31]([C:32](=[O:33])[OH:34])[cH:35][cH:36]1.[NH:1]1[CH2:2][CH2:3][CH:4]([c:7]2[cH:8][cH:9][c:10]([NH:13][C:14](=[O:15])[c:16]3[s:17][cH:18][c:19](-[c:21]4[cH:22][cH:23][cH:24][cH:25][cH:26]4)[cH:20]3)[cH:11][cH:12]2)[CH2:5][CH2:6]1.[O:46]1[CH2:47][CH2:48][O:49][CH2:50][CH2:51]1>>[N:1]1([c:28]2[n:29][cH:30][c:31]([C:32](=[O:33])[OH:34])[cH:35][cH:36]2)[CH2:2][CH2:3][CH:4]([c:7]2[cH:8][cH:9][c:10]([NH:13][C:14](=[O:15])[c:16]3[s:17][cH:18][c:19](-[c:21]4[cH:22][cH:23][cH:24][cH:25][cH:26]4)[cH:20]3)[cH:11][cH:12]2)[CH2:5][CH2:6]1Participants
5
Sources & evidence
- ORD record
- ord-ae2e085411f546b683a89f4b0ced54c1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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