Acetone → HCID 178460043, compound

HRID 1565339Notes

Reaction equation

HRID 1565339 reaction equation
[CH3:38][O:39][C:40]([CH3:41])([CH3:42])[O:43][CH3:44].[CH3:45][c:46]1[cH:47][cH:48][c:49]([S:50](=[O:51])(=[O:52])[OH:53])[cH:54][cH:55]1.[CH3:56][C:57](=[O:58])[CH3:59].[Cl:1][c:2]1[n:3][c:4]([NH:23][CH2:24][CH:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:5]2[n:6][cH:7][n:8]([CH:11]3[CH:12]([OH:22])[CH:13]([OH:21])[CH:14]([NH:16][C:17]([CH2:18][CH3:19])=[O:20])[CH2:15]3)[c:9]2[n:10]1>>[Cl:1][c:2]1[n:3][c:4]([NH:23][CH2:24][CH:25]([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:5]2[n:6][cH:7][n:8]([CH:11]3[CH:12]4[CH:13]([CH:14]([NH:16][C:17]([CH2:18][CH3:19])=[O:20])[CH2:15]3)[O:21][C:40]([CH3:41])([CH3:42])[O:22]4)[c:9]2[n:10]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 6101p-Toluenesulfonic acidHCID 64952,2-DimethoxypropaneHCID 87240175N-[4-[2-chloro-6-(2,2-diphenylethylamino)purin-9-yl]-2,3-dihydroxycyclopentyl]propanamide

Product 1

HCID 178460043HCID 178460043, compound

Sources & evidence

ORD record
ord-a9b783020e2e432db7c2bb9e287c23df
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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