Methanol → HCID 178467372, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][c:4]1[n:5][c:6]2[c:7]([n:8]1[CH2:9][c:10]1[cH:11][cH:12][c:13](-[c:16]3[c:17](-[c:22]4[n:23][n:24][n:25][n:26]4[C:27]([c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)([c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[c:40]4[cH:41][cH:42][cH:43][cH:44][cH:45]4)[cH:18][cH:19][cH:20][cH:21]3)[cH:14][cH:15]1)[c:46]([C:50](=[O:51])[O:52][CH:53]([CH3:54])[O:55][C:56](=[O:57])[CH:58]1[CH2:59][CH:60]([O:67][CH3:68])[CH:61]([O:63][N+:64](=[O:65])[O-:66])[CH2:62]1)[cH:47][cH:48][cH:49]2.[CH3:69][OH:70]>>[CH2:1]([CH3:2])[O:3][c:4]1[n:5][c:6]2[c:7]([n:8]1[CH2:9][c:10]1[cH:11][cH:12][c:13](-[c:16]3[c:17](-[c:22]4[nH:23][n:24][n:25][n:26]4)[cH:18][cH:19][cH:20][cH:21]3)[cH:14][cH:15]1)[c:46]([C:50](=[O:51])[O:52][CH:53]([CH3:54])[O:55][C:56](=[O:57])[CH:58]1[CH2:59][CH:60]([O:67][CH3:68])[CH:61]([O:63][N+:64](=[O:65])[O-:66])[CH2:62]1)[cH:47][cH:48][cH:49]2Participants
3
Sources & evidence
- ORD record
- ord-96fae545008b46b5a48a98db45161d60
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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