Water → HCID 86646784, compound
Reaction equation
[CH2:40]1[O:41][CH2:42][CH2:43][O:44][CH2:45]1.[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[n:9][cH:10][n:11][c:12]([NH:14][CH:15]([CH2:16][O:17][CH3:18])[CH3:19])[cH:13]2)[n:7]1.[Cl:20][c:21]1[cH:22][c:23]([NH2:24])[cH:25][cH:26][cH:27]1.[OH2:28].[c:29]1([CH3:30])[cH:31][cH:32][c:33]([S:34]([OH:35])(=[O:36])=[O:37])[cH:38][cH:39]1>>[c:2]1([NH:24][c:23]2[cH:22][c:21]([Cl:20])[cH:27][cH:26][cH:25]2)[n:3][cH:4][cH:5][c:6](-[c:8]2[n:9][cH:10][n:11][c:12]([NH:14][CH:15]([CH2:16][O:17][CH3:18])[CH3:19])[cH:13]2)[n:7]1Participants
6
Sources & evidence
- ORD record
- ord-a38a7fdd8eae4c6fa8a34afa5ba05c99
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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