Water → HCID 178491443, compound
Reaction equation
[CH3:1][CH:2]1[N:3]([CH:28]([CH3:29])[c:30]2[cH:31][cH:32][c:33]([CH2:36][C:37]([CH3:38])([CH3:39])[OH:40])[cH:34][cH:35]2)[C:4](=[O:27])[O:5][C:6]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)([CH2:14][CH2:15][CH2:16][O:17][CH2:18][c:19]2[cH:20][cH:21][c:22]([O:25][CH3:26])[cH:23][cH:24]2)[CH2:7]1.[Cl:41][CH2:42][Cl:43].[OH2:44]>>[CH2:2]1[N:3]([CH:28]([CH3:29])[c:30]2[cH:31][cH:32][c:33]([CH2:36][C:37]([CH3:38])([CH3:39])[OH:40])[cH:34][cH:35]2)[C:4](=[O:27])[O:5][C:6]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)([CH2:14][CH2:15][CH2:16][O:17][CH2:18][c:19]2[cH:20][cH:21][c:22]([O:25][CH3:26])[cH:23][cH:24]2)[CH2:7]1Participants
4
Sources & evidence
- ORD record
- ord-bb353d3fd33a41cc8a700e14a9eea21b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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