Sodium ion → HCID 59645413, compound

HRID 115097Notes

Reaction equation

HRID 115097 reaction equation
[CH2:9]([O:11][C:12](=[O:10])[CH2:13][CH2:14][c:15]1[cH:16][cH:17][c:18]([O:21][c:22]2[cH:23][cH:24][c:25]([CH:28]([CH2:29][c:30]3[cH:31][n:32][cH:33][cH:34][cH:35]3)[C:36]([N:37]([CH3:38])[CH3:39])=[O:40])[cH:26][cH:27]2)[cH:19][cH:20]1)[CH3:41].[CH3:2][CH2:3][O-:4].[CH3:50][CH2:51][O:52][C:53](=[O:54])[CH3:55].[NH2:5][C:6]([NH2:7])=[O:8].[Na+:1].[OH2:49].[OH:42][C:43]([C:44]([F:45])([F:46])[F:47])=[O:48]>>[NH:5]([C:6]([NH2:7])=[O:8])[C:12](=[O:11])[CH2:13][CH2:14][c:15]1[cH:16][cH:17][c:18]([O:21][c:22]2[cH:23][cH:24][c:25]([CH:28]([CH2:29][c:30]3[cH:31][n:32][cH:33][cH:34][cH:35]3)[C:36]([N:37]([CH3:38])[CH3:39])=[O:40])[cH:26][cH:27]2)[cH:19][cH:20]1

Participants

8

Reactant 7

HCID 923Sodium ionHCID 962WaterHCID 1176UreaHCID 6422Trifluoroacetic acidHCID 8857Ethyl AcetateHCID 1194401-Hydroxyethyl radicalHCID 59645434HCID 59645434, compound

Product 1

HCID 59645413HCID 59645413, compound

Sources & evidence

ORD record
ord-06800c48555f492188bfaa4d5a98c7c6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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