1,4-Dioxane → HCID 178476460, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[C:8]1([OH:9])[CH:10]([NH:52][C:53]([O:54][CH2:55][c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)=[O:62])[CH:11]([O:12][C:13]([CH3:14])=[O:15])[CH:16]([O:17][C:18]([CH3:19])=[O:20])[CH:21]([CH2:23][NH:24][C:25](=[O:26])[CH:27]([O:28][C:29]([CH3:30])=[O:31])[CH:32]([O:33][C:34]([CH3:35])=[O:36])[CH:37]([O:38][C:39]([CH3:40])=[O:41])[CH:42]([O:43][C:44]([CH3:45])=[O:46])[CH2:47][O:48][C:49]([CH3:50])=[O:51])[O:22]1.[O:63]1[CH2:64][CH2:65][O:66][CH2:67][CH2:68]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[C:8]1([OH:9])[CH:10]([NH2:52])[CH:11]([O:12][C:13]([CH3:14])=[O:15])[CH:16]([O:17][C:18]([CH3:19])=[O:20])[CH:21]([CH2:23][NH:24][C:25](=[O:26])[CH:27]([O:28][C:29]([CH3:30])=[O:31])[CH:32]([O:33][C:34]([CH3:35])=[O:36])[CH:37]([O:38][C:39]([CH3:40])=[O:41])[CH:42]([O:43][C:44]([CH3:45])=[O:46])[CH2:47][O:48][C:49]([CH3:50])=[O:51])[O:22]1Participants
3
Sources & evidence
- ORD record
- ord-8e7b664cb88348829fc598e68f81fee9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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