Methanol → HCID 86755061, compound
Reaction equation
[CH3:17][O:18][C:19](=[O:20])[C:21]12[CH2:22][N:23]([CH2:39][c:40]3[cH:41][cH:42][cH:43][cH:44][cH:45]3)[CH2:24][CH:25]1[C:26]([I:38])=[CH:27][CH2:28][CH:29]2[c:30]1[c:31]([O:36][CH3:37])[cH:32][cH:33][cH:34][cH:35]1.[CH3:1][c:2]1[cH:3][cH:4][c:5]([B:8]([OH:9])[OH:10])[cH:6][cH:7]1.[CH3:46][OH:47].[CH3:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[Na+:11].[Na+:12].[O-:13][C:14](=[O:15])[O-:16].[cH:55]1[cH:56][cH:57][c:58]([P:59]([Pd:60]([P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)([P:80]([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)([c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)[c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)[P:99]([c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)([c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)[c:112]2[cH:113][cH:114][cH:115][cH:116][cH:117]2)([c:118]2[cH:119][cH:120][cH:121][cH:122][cH:123]2)[c:124]2[cH:125][cH:126][cH:127][cH:128][cH:129]2)[cH:130][cH:131]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([C:26]2=[CH:27][CH2:28][CH:29]([c:30]3[c:31]([O:36][CH3:37])[cH:32][cH:33][cH:34][cH:35]3)[C:21]3([C:19]([O:18][CH3:17])=[O:20])[CH2:22][N:23]([CH2:39][c:40]4[cH:41][cH:42][cH:43][cH:44][cH:45]4)[CH2:24][CH:25]32)[cH:6][cH:7]1Participants
8
Sources & evidence
- ORD record
- ord-cf7c93635301493cb6fb012ee76ec82d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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