Water → HCID 54552025, compound
Reaction equation
[CH3:1][N:2]([CH2:3][CH2:4][CH:5]=[C:6]1[c:7]2[c:8]([cH:17][cH:18][c:19]([CH2:21][CH2:22][O:23][C:24]([c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)([c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[c:37]3[cH:38][cH:39][cH:40][cH:41][cH:42]3)[cH:20]2)[O:9][CH2:10][c:11]2[c:12]1[cH:13][cH:14][cH:15][cH:16]2)[CH3:43].[O:56]1[CH2:57][CH2:58][O:59][CH2:60][CH2:61]1.[OH2:44].[c:45]1([CH3:46])[cH:47][cH:48][c:49]([S:50]([OH:51])(=[O:52])=[O:53])[cH:54][cH:55]1>>[CH3:1][N:2]([CH2:3][CH2:4][CH:5]=[C:6]1[c:7]2[c:8]([cH:17][cH:18][c:19]([CH2:21][CH2:22][OH:23])[cH:20]2)[O:9][CH2:10][c:11]2[c:12]1[cH:13][cH:14][cH:15][cH:16]2)[CH3:43]Participants
5
Sources & evidence
- ORD record
- ord-a4af9adfd8fd468db353353ea40b9145
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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