Acetone → HCID 178473297, compound
Reaction equation
[CH3:42][C:43](=[O:44])[CH3:45].[CH:1](=[CH2:2])[O:3][C:4](=[O:5])[N:6]1[CH2:7][CH:8]2[CH2:9][CH:10]3[C:11]([CH3:39])([CH2:12][CH:13]([OH:28])[C:14]4([F:27])[C:15]5([CH3:26])[CH:16]=[CH:17][C:18](=[O:25])[CH:19]=[C:20]5[CH:21]([F:24])[CH2:22][CH:23]34)[C:29]2([C:31]([CH2:32][O:33][S:34]([CH3:35])(=[O:36])=[O:37])=[O:38])[CH2:30]1.[I-:41].[Na+:40]>>[CH:1](=[CH2:2])[O:3][C:4](=[O:5])[N:6]1[CH2:7][CH:8]2[CH2:9][CH:10]3[C:11]([CH3:39])([CH2:12][CH:13]([OH:28])[C:14]4([F:27])[C:15]5([CH3:26])[CH:16]=[CH:17][C:18](=[O:25])[CH:19]=[C:20]5[CH:21]([F:24])[CH2:22][CH:23]34)[C:29]2([C:31]([CH3:32])=[O:38])[CH2:30]1Participants
5
Sources & evidence
- ORD record
- ord-007ec46df34e4a8fabc2e0acc0254aa9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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