Acetone → HCID 178431239, compound

HRID 321090Notes

Reaction equation

HRID 321090 reaction equation
[CH3:26][O:27][C:28]([CH3:29])([CH3:30])[O:31][CH3:32].[CH3:45][C:46](=[O:47])[CH3:48].[OH2:33].[OH:1][CH2:2][CH:3]1[CH:4]([OH:25])[CH:5]([OH:24])[CH:6]([n:8]2[cH:9][cH:10][c:11]3[c:12]2[n:13][cH:14][n:15][c:16]3[S:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[CH2:7]1.[c:34]1([CH3:35])[cH:36][cH:37][c:38]([S:39]([OH:40])(=[O:41])=[O:42])[cH:43][cH:44]1>>[OH:1][CH2:2][CH:3]1[CH:4]2[CH:5]([CH:6]([n:8]3[cH:9][cH:10][c:11]4[c:12]3[n:13][cH:14][n:15][c:16]4[S:17][c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[CH2:7]1)[O:24][C:28]([CH3:29])([CH3:30])[O:25]2

Participants

6

Reactant 5

HCID 180AcetoneHCID 962WaterHCID 6101p-Toluenesulfonic acidHCID 64952,2-DimethoxypropaneHCID 178519746HCID 178519746, compound

Product 1

HCID 178431239HCID 178431239, compound

Sources & evidence

ORD record
ord-689056fbe71f49bbb31dfe393303dc3e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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