HCID 90700328, compound → HCID 69603164, compound
Reaction equation
[CH2:38]([CH3:39])[c:40]1[cH:41][c:42]([CH2:45][CH2:46][c:47]2[cH:48][c:49]3[n:50]([c:51](=[O:70])[c:52]([CH:61]=[CH:62][C:63](=[O:64])[O:65][C:66]([CH3:67])([CH3:68])[CH3:69])[c:53]([N:55]4[CH2:56][CH2:57][O:58][CH2:59][CH2:60]4)[n:54]3)[cH:71][cH:72]2)[s:43][cH:44]1.[OH:1][CH:2]1[CH2:3][CH2:4][CH2:5][N:6]([c:7]2[n:8][c:9]3[cH:10][c:11]([O:12][CH2:13][c:14]4[s:15][cH:16][c:17]([CH:18]([CH3:19])[CH3:20])[n:21]4)[cH:22][cH:23][n:24]3[c:25](=[O:26])[c:27]2[CH:28]=[CH:29][C:30]([O:31][C:32]([CH3:33])([CH3:34])[CH3:35])=[O:36])[CH2:37]1>>[CH2:38]([CH3:39])[c:40]1[cH:41][c:42]([CH2:45][CH2:46][c:47]2[cH:48][c:49]3[n:50]([c:51](=[O:70])[c:52]([CH:61]=[CH:62][C:63](=[O:64])[OH:65])[c:53]([N:55]4[CH2:56][CH2:57][O:58][CH2:59][CH2:60]4)[n:54]3)[cH:71][cH:72]2)[s:43][cH:44]1Participants
3
Sources & evidence
- ORD record
- ord-eda3355a384f4b84ae2ded6b1e3b6762
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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