Ammonium → HCID 178475935, compound

HRID 1556782Notes

Reaction equation

HRID 1556782 reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[CH:6]([c:24]2[cH:25][c:26]([CH2:31][c:32]3[s:33][c:34]([Cl:37])[cH:35][cH:36]3)[c:27]([CH3:30])[cH:28][cH:29]2)[O:7][CH:8]([CH2:19][O:20][C:21]([CH3:22])=[O:23])[CH:9]([O:15][C:16]([CH3:17])=[O:18])[CH:10]1[O:11][C:12]([CH3:13])=[O:14].[CH:59](=[CH:60][C:61]([CH:62]=[CH:63][c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1)=[O:70])[c:71]1[cH:72][cH:73][cH:74][cH:75][cH:76]1.[CH:77](=[CH:78][C:79]([CH:80]=[CH:81][c:82]1[cH:83][cH:84][cH:85][cH:86][cH:87]1)=[O:88])[c:89]1[cH:90][cH:91][cH:92][cH:93][cH:94]1.[CH:95](=[CH:96][C:97]([CH:98]=[CH:99][c:100]1[cH:101][cH:102][cH:103][cH:104][cH:105]1)=[O:106])[c:107]1[cH:108][cH:109][cH:110][cH:111][cH:112]1.[Cl-:50].[F-:48].[F:38][c:39]1[cH:40][cH:41][c:42]([B:45]([OH:46])[OH:47])[cH:43][n:44]1.[K+:49].[NH4+:51].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[Pd:57].[Pd:58]>>[C:1]([CH3:2])(=[O:3])[O:4][CH:5]1[CH:6]([c:24]2[cH:25][c:26]([CH2:31][c:32]3[s:33][c:34](-[c:42]4[cH:41][cH:40][c:39]([F:38])[n:44][cH:43]4)[cH:35][cH:36]3)[c:27]([CH3:30])[cH:28][cH:29]2)[O:7][CH:8]([CH2:19][O:20][C:21]([CH3:22])=[O:23])[CH:9]([O:15][C:16]([CH3:17])=[O:18])[CH:10]1[O:11][C:12]([CH3:13])=[O:14]

Participants

10

Reactant 9

HCID 223AmmoniumHCID 312ChlorideHCID 813Potassium CationHCID 8028TetrahydrofuranHCID 23938Palladium2×HCID 28179Fluoride IonHCID 95417Dibenzylidene acetone3×HCID 2783397(6-Fluoropyridin-3-yl)boronic acidHCID 72629788[3,4,5-Triacetyloxy-6-[3-[(5-chlorothiophen-2-yl)methyl]-4-methylphenyl]oxan-2-yl]methyl acetate

Product 1

HCID 178475935HCID 178475935, compound

Sources & evidence

ORD record
ord-44bcb164af404b8388e1877432975a48
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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