Methanol → HCID 77246441, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[O:8][c:9]1[n:10][c:11]2[c:12]([O:57][C:58](=[O:59])[O:60][C:61]([CH3:62])([CH3:63])[CH3:64])[cH:13][cH:14][c:15]([CH:19]([CH2:20][N:21]([C:22]([O:23][C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][O:35][CH2:36][CH2:37][CH2:38][CH2:39][c:40]3[cH:41][cH:42][c:43]([N+:46]([O-:47])=[O:48])[cH:44][cH:45]3)[O:49][Si:50]([CH3:51])([CH3:52])[C:53]([CH3:54])([CH3:55])[CH3:56])[c:16]2[cH:17][cH:18]1.[CH3:65][CH2:66][O:67][C:68](=[O:69])[CH3:70].[CH3:73][OH:74].[H:71][H:72]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[O:8][c:9]1[n:10][c:11]2[c:12]([O:57][C:58](=[O:59])[O:60][C:61]([CH3:62])([CH3:63])[CH3:64])[cH:13][cH:14][c:15]([CH:19]([CH2:20][N:21]([C:22]([O:23][C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][O:35][CH2:36][CH2:37][CH2:38][CH2:39][c:40]3[cH:41][cH:42][c:43]([NH2:46])[cH:44][cH:45]3)[O:49][Si:50]([CH3:51])([CH3:52])[C:53]([CH3:54])([CH3:55])[CH3:56])[c:16]2[cH:17][cH:18]1Participants
5
Sources & evidence
- ORD record
- ord-11b0f1694b864d17bdd0a974f6dfa20e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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