Sodium ion → HCID 178491307, compound

HRID 1548565Notes

Reaction equation

HRID 1548565 reaction equation
[Br:1][c:2]1[cH:3][n:4][cH:5][c:6]([O:8][c:9]2[cH:10][c:11]([O:15][CH3:16])[cH:12][cH:13][cH:14]2)[cH:7]1.[C:17]([CH3:18])([CH3:19])([CH3:20])[O:21][C:22](=[O:23])[N:24]1[CH:25]2[CH2:26][NH:27][CH:28]([CH2:29]1)[CH2:30]2.[CH3:31][C:32]([CH3:33])([O-:34])[CH3:35].[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[Na+:36].[O:46]=[C:47]([CH:48]=[CH:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1)[CH:56]=[CH:57][c:58]1[cH:59][cH:60][cH:61][cH:62][cH:63]1.[O:64]=[C:65]([CH:66]=[CH:67][c:68]1[cH:69][cH:70][cH:71][cH:72][cH:73]1)[CH:74]=[CH:75][c:76]1[cH:77][cH:78][cH:79][cH:80][cH:81]1.[O:82]=[C:83]([CH:84]=[CH:85][c:86]1[cH:87][cH:88][cH:89][cH:90][cH:91]1)[CH:92]=[CH:93][c:94]1[cH:95][cH:96][cH:97][cH:98][cH:99]1.[OH2:100].[Pd:44].[Pd:45]>>[c:2]1([N:27]2[CH2:26][CH:25]3[N:24]([C:22]([O:21][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:23])[CH2:29][CH:28]2[CH2:30]3)[cH:3][n:4][cH:5][c:6]([O:8][c:9]2[cH:10][c:11]([O:15][CH3:16])[cH:12][cH:13][cH:14]2)[cH:7]1

Participants

9

Reactant 8

HCID 923Sodium ionHCID 962WaterHCID 1140TolueneHCID 23938Palladium2×HCID 95417Dibenzylidene acetone3×HCID 2760898(1S,4S)-tert-butyl 2,5-diazabicyclo(2.2.1)heptane-2-carboxylateHCID 45749132-Methylpropan-2-olateHCID 22573906HCID 22573906, compound

Product 1

HCID 178491307HCID 178491307, compound

Sources & evidence

ORD record
ord-25b4bf5149214d5e98ed4979828425bb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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