Ethanol → HCID 68455205, compound
Reaction equation
[Br:1][c:2]1[cH:3][c:4]2[cH:5][n:6][n:7][c:8]([N:12]3[CH:13]4[CH2:14][N:15]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH:16]([CH2:17]3)[CH2:18]4)[c:9]2[cH:10][cH:11]1.[C:48](=[O:49])([O-:50])[O-:51].[CH3:54][O:55][CH2:56][CH2:57][O:58][CH3:59].[CH3:60][CH2:61][OH:62].[CH:26]1([NH:29][C:30]([c:31]2[cH:32][c:33]([B:38]3[O:39][C:40]([CH3:41])([CH3:42])[C:43]([CH3:44])([CH3:45])[O:46]3)[c:34]([CH3:37])[cH:35][cH:36]2)=[O:47])[CH2:27][CH2:28]1.[K+:52].[K+:53].[cH:63]1[cH:64][cH:65][c:66]([P:67]([Pd:68]([P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)([P:88]([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[P:107]([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)([c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)([c:126]2[cH:127][cH:128][cH:129][cH:130][cH:131]2)[c:132]2[cH:133][cH:134][cH:135][cH:136][cH:137]2)[cH:138][cH:139]1>>[c:2]1(-[c:33]2[cH:32][c:31]([C:30]([NH:29][CH:26]3[CH2:27][CH2:28]3)=[O:47])[cH:36][cH:35][c:34]2[CH3:37])[cH:3][c:4]2[cH:5][n:6][n:7][c:8]([N:12]3[CH:13]4[CH2:14][N:15]([C:19](=[O:20])[O:21][C:22]([CH3:23])([CH3:24])[CH3:25])[CH:16]([CH2:17]3)[CH2:18]4)[c:9]2[cH:10][cH:11]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-e1ca2fcc3ad04f23becdf93a271c4dda
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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