Ethanol → HCID 69684400, compound
Reaction equation
[CH3:50][CH2:51][OH:52].[CH:1]1([S:6][c:7]2[cH:8][c:9]([CH2:10][O:11][CH2:12][CH2:13][O:14][c:15]3[cH:16][cH:17][c:18]([CH2:21][CH2:22][N:23]4[C:24](=[O:40])[O:25][CH:26]([c:28]5[cH:29][c:30]6[c:31]([cH:38][cH:39]5)[O:32][C:33]([CH3:36])([CH3:37])[O:34][CH2:35]6)[CH2:27]4)[cH:19][cH:20]3)[cH:41][cH:42][cH:43]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[I+3:44]([O-:45])([O-:46])([O-:47])[O-:48].[Na+:49].[OH2:53]>>[CH:1]1([S:6]([c:7]2[cH:8][c:9]([CH2:10][O:11][CH2:12][CH2:13][O:14][c:15]3[cH:16][cH:17][c:18]([CH2:21][CH2:22][N:23]4[C:24](=[O:40])[O:25][CH:26]([c:28]5[cH:29][c:30]6[c:31]([cH:38][cH:39]5)[O:32][C:33]([CH3:36])([CH3:37])[O:34][CH2:35]6)[CH2:27]4)[cH:19][cH:20]3)[cH:41][cH:42][cH:43]2)=[O:45])[CH2:2][CH2:3][CH2:4][CH2:5]1Participants
6
Sources & evidence
- ORD record
- ord-7662004f91f746abbdd6de13411cf05e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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