Methanol → HCID 59638329, compound
Reaction equation
[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[CH3:65][N:66]([c:67]1[cH:68][cH:69][n:70][cH:71][cH:72]1)[CH3:73].[CH3:74][OH:75].[CH:35]12[CH:36]([C:42](=[O:43])[OH:44])[CH2:37][CH:38]([CH:39]=[CH:40]1)[CH2:41]2.[CH:50]1([N:51]=[C:52]=[N:53][CH:54]2[CH2:55][CH2:56][CH2:57][CH2:58][CH2:59]2)[CH2:60][CH2:61][CH2:62][CH2:63][CH2:64]1.[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:6]3[cH:7][cH:8][cH:9][cH:10][c:11]3[n:12](-[c:14]3[cH:15][c:16]([CH2:33][OH:34])[cH:17][c:18](-[n:20]4[c:21]5[cH:22][cH:23][cH:24][cH:25][c:26]5[c:27]5[cH:28][cH:29][cH:30][cH:31][c:32]45)[cH:19]3)[c:13]12>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:6]3[cH:7][cH:8][cH:9][cH:10][c:11]3[n:12](-[c:14]3[cH:15][c:16]([CH2:33][O:34][C:42]([CH:36]4[CH:35]5[CH:40]=[CH:39][CH:38]([CH2:37]4)[CH2:41]5)=[O:43])[cH:17][c:18](-[n:20]4[c:21]5[cH:22][cH:23][cH:24][cH:25][c:26]5[c:27]5[cH:28][cH:29][cH:30][cH:31][c:32]45)[cH:19]3)[c:13]12Participants
7
Sources & evidence
- ORD record
- ord-7f922af0988d48bd98be3c432c4bbc45
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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