Tetrahydrofuran → HCID 178486333, compound
Reaction equation
[O:61]1[CH2:62][CH2:63][CH2:64][CH2:65]1.[c:1]1(-[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[cH:2][cH:3][c:4]([C:7]2([O:53][CH3:54])[CH2:8][CH:9]3[C:10](=[O:52])[NH:11][C:12]4([C:47](=[O:48])[O:49][CH2:50][CH3:51])[CH:13]([CH:14]=[CH:15][CH2:16][CH2:17][CH2:18][N:19]([S:34](=[O:35])(=[O:36])[c:37]5[c:38]([N+:43](=[O:44])[O-:45])[cH:39][cH:40][cH:41][cH:42]5)[CH2:20][CH:21]([NH:26][C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[C:22](=[O:25])[N:23]3[CH2:24]2)[CH2:46]4)[cH:5][cH:6]1>>[c:1]1(-[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[cH:2][cH:3][c:4]([C:7]2([O:53][CH3:54])[CH2:8][CH:9]3[C:10](=[O:52])[NH:11][C:12]4([C:47](=[O:48])[OH:49])[CH:13]([CH:14]=[CH:15][CH2:16][CH2:17][CH2:18][N:19]([S:34](=[O:35])(=[O:36])[c:37]5[c:38]([N+:43](=[O:44])[O-:45])[cH:39][cH:40][cH:41][cH:42]5)[CH2:20][CH:21]([NH:26][C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[C:22](=[O:25])[N:23]3[CH2:24]2)[CH2:46]4)[cH:5][cH:6]1Participants
3
Sources & evidence
- ORD record
- ord-69c8e0c9c69e45de984c4328a09e34b9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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