Ethanol → HCID 178519425, compound

HRID 1114912Notes

Reaction equation

HRID 1114912 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7]1)[O:8][C:9]1([CH:10]3[CH2:11][CH2:12][N:13]([CH2:14]1)[CH2:15][CH2:16]3)[CH2:17]2.[C:29](=[O:30])([O-:31])[O-:32].[CH3:35][O:36][CH2:37][CH2:38][O:39][CH3:40].[CH3:82][CH2:83][OH:84].[CH:19](=[O:20])[c:21]1[cH:22][cH:23][c:24]([B:26]([OH:27])[OH:28])[o:25]1.[Na+:33].[Na+:34].[OH2:18].[Pd:41]([Cl:42])[Cl:43].[c:44]1([P:45]([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[cH:58][cH:59][cH:60][cH:61][cH:62]1.[c:63]1([P:64]([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)[cH:77][cH:78][cH:79][cH:80][cH:81]1>>[c:2]1(-[c:24]2[cH:23][cH:22][c:21]([CH:19]=[O:20])[o:25]2)[cH:3][c:4]2[c:5]([n:6][cH:7]1)[O:8][C:9]1([CH:10]3[CH2:11][CH2:12][N:13]([CH2:14]1)[CH2:15][CH2:16]3)[CH2:17]2

Participants

10

Reactant 9

HCID 702EthanolHCID 923Sodium ion2×HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 11776Triphenylphosphine2×HCID 19660Carbonate IonHCID 24290Palladium ChlorideHCID 27343555-Formylfuran-2-boronic acidHCID 103571335'-bromospiro[1-azabicyclo[2.2.2]octane-3,2'(3'H)-furo[2,3-b]pyridine]

Product 1

HCID 178519425HCID 178519425, compound

Sources & evidence

ORD record
ord-7d9b7fe082f34335b5409a764baa625e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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