Sodium ion → HCID 71086881, compound

HRID 1128392Notes

Reaction equation

HRID 1128392 reaction equation
[C:8](#[N:9])[c:10]1[cH:11][c:12]([CH:31]2[O:32][CH2:33][CH2:34][N:35]([C:37]([O:38][C:39]([CH3:40])([CH3:41])[CH3:42])=[O:43])[CH2:36]2)[cH:13][cH:14][c:15]1[NH:16][C:17](=[O:18])[c:19]1[n:20][n:21](-[c:24]2[cH:25][cH:26][c:27]([F:30])[cH:28][cH:29]2)[cH:22][cH:23]1.[CH3:47][C:48]#[N:49].[Na+:45].[OH-:44].[OH2:46].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[C:8](#[N:9])[c:10]1[cH:11][c:12]([CH:31]2[O:32][CH2:33][CH2:34][NH:35][CH2:36]2)[cH:13][cH:14][c:15]1[NH:16][C:17](=[O:18])[c:19]1[n:20][n:21](-[c:24]2[cH:25][cH:26][c:27]([F:30])[cH:28][cH:29]2)[cH:22][cH:23]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6342AcetonitrileHCID 6422Trifluoroacetic acidHCID 86674687HCID 86674687, compound

Product 1

HCID 71086881HCID 71086881, compound

Sources & evidence

ORD record
ord-f565d3de39a14736bfe6a50d8a681dab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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