Acetone → HCID 59254999, compound

HRID 319987Notes

Reaction equation

HRID 319987 reaction equation
[CH3:28][N+:29]1([O-:30])[CH2:31][CH2:33][O:32][CH2:34][CH2:35]1.[CH3:42][C:43](=[O:44])[CH3:45].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[CH:1](=[CH2:2])[c:3]1[cH:4][cH:5][c:6]2[c:15]([cH:16]1)[C:14]13[CH:9]([CH:8]([CH2:7]2)[N:19]([C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:18][CH2:17]1)[CH2:10][CH2:11][CH2:12][CH2:13]3.[Na+:40].[Na+:41].[OH2:27].[S:36]([O-:37])([O-:38])=[O:39]>>[CH:1]([CH2:2][OH:32])([c:3]1[cH:4][cH:5][c:6]2[c:15]([cH:16]1)[C:14]13[CH:9]([CH:8]([CH2:7]2)[N:19]([C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:18][CH2:17]1)[CH2:10][CH2:11][CH2:12][CH2:13]3)[OH:27]

Participants

8

Reactant 7

HCID 180AcetoneHCID 923Sodium ion2×HCID 962WaterHCID 1099SulfiteHCID 8857Ethyl AcetateHCID 82029Methyl morpholine oxideHCID 59254979HCID 59254979, compound

Product 1

HCID 59254999HCID 59254999, compound

Sources & evidence

ORD record
ord-bc11a2c262c74711874ff1b7a1cebb0d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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