Potassium Cation → HCID 58097118, compound

HRID 1210920Notes

Reaction equation

HRID 1210920 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[n:5]1[n:6][cH:7][cH:8][c:9]1[NH:10][c:11]1[cH:12][c:13]([O:36][S:37]([C:38]([F:39])([F:40])[F:41])(=[O:42])=[O:43])[cH:14][c:15]([CH2:17][C:18]2([C:31](=[O:32])[O:33][CH2:34][CH3:35])[CH2:19][CH2:20][N:21]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:22][CH2:23]2)[n:16]1.[CH2:61]1[O:62][CH2:63][CH2:64][O:65][CH2:66]1.[CH3:67][CH2:68][O:69][C:70](=[O:71])[CH3:72].[K+:58].[K+:59].[K+:60].[OH2:73].[OH:44][B:45]([OH:46])[c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[P:53]([O-:54])([O-:55])([O-:56])=[O:57]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[n:5]1[n:6][cH:7][cH:8][c:9]1[NH:10][c:11]1[cH:12][c:13](-[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[cH:14][c:15]([CH2:17][C:18]2([C:31](=[O:32])[O:33][CH2:34][CH3:35])[CH2:19][CH2:20][N:21]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:22][CH2:23]2)[n:16]1

Participants

8

Reactant 7

HCID 813Potassium Cation3×HCID 962WaterHCID 1061PhosphateHCID 8857Ethyl AcetateHCID 312751,4-DioxaneHCID 66827Phenylboronic AcidHCID 86649626HCID 86649626, compound

Product 1

HCID 58097118HCID 58097118, compound

Sources & evidence

ORD record
ord-d24efacb32524c948e150b5c5d52a655
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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