Ethanol → HCID 57932955, compound
Reaction equation
[Br:1][c:2]1[n:3][c:4]([N:23]2[CH2:24][CH2:25][O:26][CH2:27][CH2:28]2)[s:5][c:6]1-[c:7]1[c:8]([CH3:22])[n:9][c:10]2[n:11]1[n:12][c:13]([CH3:21])[cH:14][c:15]2[CH:16]([CH2:17][CH3:18])[CH2:19][CH3:20].[CH3:42][O:43][CH2:44][CH2:45][O:46][CH3:47].[CH3:49][CH2:50][OH:51].[Cl:38][CH2:39][Cl:40].[OH2:41].[OH2:48].[OH:29][B:30]([OH:31])[c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[cH:52]1[cH:53][cH:54][c:55]([P:56]([Pd:57]([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([P:77]([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)[P:96]([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)([c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)([c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[c:121]2[cH:122][cH:123][cH:124][cH:125][cH:126]2)[cH:127][cH:128]1>>[c:2]1(-[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[n:3][c:4]([N:23]2[CH2:24][CH2:25][O:26][CH2:27][CH2:28]2)[s:5][c:6]1-[c:7]1[c:8]([CH3:22])[n:9][c:10]2[n:11]1[n:12][c:13]([CH3:21])[cH:14][c:15]2[CH:16]([CH2:17][CH3:18])[CH2:19][CH3:20]Participants
8
Sources & evidence
- ORD record
- ord-1df41009bfda445a8e7f1a52695ff697
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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