1,4-Dioxane → HCID 178474438, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[s:6][c:7]([C:36](=[O:37])[N:38]2[CH2:39][CH2:40][CH:41]([C:44](=[O:45])[O:46][CH2:47][CH3:48])[CH2:42][CH2:43]2)[c:8]([CH2:10][CH2:11][c:12]2[cH:13][cH:14][c:15]([NH:18][C:19](=[N:20][C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[NH:28][C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[cH:16][cH:17]2)[n:9]1.[CH2:49]1[O:50][CH2:51][CH2:52][O:53][CH2:54]1>>[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[s:6][c:7]([C:36](=[O:37])[N:38]2[CH2:39][CH2:40][CH:41]([C:44](=[O:45])[OH:46])[CH2:42][CH2:43]2)[c:8]([CH2:10][CH2:11][c:12]2[cH:13][cH:14][c:15]([NH:18][C:19](=[N:20][C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[NH:28][C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[cH:16][cH:17]2)[n:9]1Participants
3
Sources & evidence
- ORD record
- ord-adf4ea56ca9241b093fcae05d0465543
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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