Ethanol → HCID 16065363, compound
Reaction equation
[CH3:34][CH2:35][OH:36].[CH:1]1([CH2:7][c:8]2[cH:9][c:10]3[c:11]([n:12][cH:13]2)[n:14]([S:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)(=[O:30])=[O:31])[cH:15][c:16]3-[c:17]2[cH:18][n:19][n:20]([CH3:22])[cH:21]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Na+:33].[OH-:32]>>[CH:1]1([CH2:7][c:8]2[cH:9][c:10]3[c:11]([n:12][cH:13]2)[nH:14][cH:15][c:16]3-[c:17]2[cH:18][n:19][n:20]([CH3:22])[cH:21]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
5
Sources & evidence
- ORD record
- ord-5495d5711fda46758d3320f8d97355a2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…