Sodium ion → HCID 76834633, compound

HRID 1556539Notes

Reaction equation

HRID 1556539 reaction equation
[C:62]([OH:63])([CH3:64])([CH3:65])[CH3:66].[CH2:1]([CH:2]=[CH2:3])[C:4]1([CH3:35])[C:5](=[O:34])[N:6]([CH:24]([CH2:25][N:26]2[CH2:27][CH2:28][O:29][CH2:30][CH2:31]2)[CH2:32][CH3:33])[CH:7]([c:17]2[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]2)[CH:8]([c:10]2[cH:11][c:12]([Cl:16])[cH:13][cH:14][cH:15]2)[CH2:9]1.[CH2:36]1[CH2:39][CH2:38][CH2:37][O:40]1.[CH3:41][N+:42]1([O-:43])[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1.[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[I+3:49]([O-:50])([O-:51])([O-:52])[O-:53].[Na+:54].[OH2:55]>>[CH2:1]([CH:2]=[O:40])[C:4]1([CH3:35])[C:5](=[O:34])[N:6]([CH:24]([CH2:25][N:26]2[CH2:27][CH2:28][O:29][CH2:30][CH2:31]2)[CH2:32][CH3:33])[CH:7]([c:17]2[cH:18][cH:19][c:20]([Cl:23])[cH:21][cH:22]2)[CH:8]([c:10]2[cH:11][c:12]([Cl:16])[cH:13][cH:14][cH:15]2)[CH2:9]1

Participants

9

Reactant 8

HCID 923Sodium ionHCID 962WaterHCID 6386tert-ButanolHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 82029Methyl morpholine oxideHCID 167232PeriodateHCID 76834624HCID 76834624, compound

Product 1

HCID 76834633HCID 76834633, compound

Sources & evidence

ORD record
ord-46ec83cb4bca4b2b950d728ff4e9b548
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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