HCID 178439808, compound → HCID 178439808, compound
Reaction equation
[CH:1](=[O:2])[O:3][CH:4]1[CH2:5][N:6]([c:10]2[n:11][c:12]3[n:13]([c:14](=[O:25])[c:15]2[CH:16]=[CH:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[cH:26][cH:27][c:28]([CH:30]=[CH:31][c:32]2[s:33][cH:34][c:35]([CH:37]([CH3:38])[CH3:39])[n:36]2)[cH:29]3)[CH2:7][CH2:8][CH2:9]1.[OH:40][CH:41]1[CH2:42][CH2:43][CH2:44][N:45]([c:46]2[n:47][c:48]3[cH:49][c:50]([CH:51]=[CH:52][c:53]4[s:54][cH:55][c:56]([CH:57]([CH3:58])[CH3:59])[n:60]4)[cH:61][cH:62][n:63]3[c:64](=[O:65])[c:66]2[CH:67]=[CH:68][C:69]([O:70][C:71]([CH3:72])([CH3:73])[CH3:74])=[O:75])[CH2:76]1>>[OH:3][CH:4]1[CH2:5][N:6]([c:10]2[n:11][c:12]3[n:13]([c:14](=[O:25])[c:15]2[CH:16]=[CH:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[cH:26][cH:27][c:28]([CH:30]=[CH:31][c:32]2[s:33][cH:34][c:35]([CH:37]([CH3:38])[CH3:39])[n:36]2)[cH:29]3)[CH2:7][CH2:8][CH2:9]1Participants
3
Sources & evidence
- ORD record
- ord-148be6e498b541df8a7511c20540eb13
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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