Potassium Cation → HCID 71142506, compound

HRID 2310368Notes

Reaction equation

HRID 2310368 reaction equation
[CH3:36][C:37]1([CH3:38])[C:39]([CH3:40])([CH3:41])[O:42][B:43]([c:44]2[cH:45][c:46]([NH:50][C:51](=[O:52])[CH:53]3[O:54][CH2:55][CH2:56][O:57][CH2:58]3)[cH:47][cH:48][cH:49]2)[O:59]1.[K+:65].[K+:66].[K+:67].[NH2:1][c:2]1[n:3][cH:4][cH:5][cH:6][c:7]1-[c:8]1[n:9][c:10]2[c:11]([n:12][c:13]([Cl:16])[cH:14][cH:15]2)[n:17]1-[c:18]1[cH:19][cH:20][c:21]([C:24]2([NH:28][C:29]([O:30][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])[CH2:25][CH2:26][CH2:27]2)[cH:22][cH:23]1.[O:68]1[CH2:69][CH2:70][O:71][CH2:72][CH2:73]1.[OH2:74].[P:60]([O-:61])([O-:62])([O-:63])=[O:64]>>[NH2:1][c:2]1[n:3][cH:4][cH:5][cH:6][c:7]1-[c:8]1[n:9][c:10]2[c:11]([n:12][c:13](-[c:44]3[cH:45][c:46]([NH:50][C:51](=[O:52])[CH:53]4[O:54][CH2:55][CH2:56][O:57][CH2:58]4)[cH:47][cH:48][cH:49]3)[cH:14][cH:15]2)[n:17]1-[c:18]1[cH:19][cH:20][c:21]([C:24]2([NH:28][C:29]([O:30][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:35])[CH2:25][CH2:26][CH2:27]2)[cH:22][cH:23]1

Participants

7

Reactant 6

HCID 813Potassium Cation3×HCID 962WaterHCID 1061PhosphateHCID 312751,4-DioxaneHCID 71138628N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,4-dioxane-2-carboxamideHCID 86675348HCID 86675348, compound

Product 1

HCID 71142506HCID 71142506, compound

Sources & evidence

ORD record
ord-dffc37a4498e4654a6f949e22e8b52f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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