Sodium ion → 4-{Cyclooctylidene[4-(3,5-dimethyl-4-isoxazolyl)phenyl]methyl}phenol
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([C:8]([c:9]2[cH:10][cH:11][c:12]([OH:15])[cH:13][cH:14]2)=[C:16]2[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23]2)[cH:6][cH:7]1.[C:34](=[O:35])([O-:36])[O-:37].[CH2:81]1[O:82][CH2:83][CH2:84][CH2:85]1.[CH3:24][c:25]1[n:26][o:27][c:28]([CH3:33])[c:29]1[B:30]([OH:31])[OH:32].[Na+:38].[Na+:39].[OH2:86].[Pd:40]([Cl:41])[Cl:42].[c:43]1([P:44]([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[cH:57][cH:58][cH:59][cH:60][cH:61]1.[c:62]1([P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[cH:76][cH:77][cH:78][cH:79][cH:80]1>>[c:2]1(-[c:29]2[c:25]([CH3:24])[n:26][o:27][c:28]2[CH3:33])[cH:3][cH:4][c:5]([C:8]([c:9]2[cH:10][cH:11][c:12]([OH:15])[cH:13][cH:14]2)=[C:16]2[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23]2)[cH:6][cH:7]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-bd58627cfb664d8c81a7b2282cd1b466
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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