Acetone → HCID 13589522, compound

HRID 1569365Notes

Reaction equation

HRID 1569365 reaction equation
[CH3:1][OH:2].[CH3:41][C:42](=[O:43])[CH3:44].[CH3:4][C:5]1([c:10]2[cH:11][c:12]([CH:16]3[C:17]([C:26](=[O:27])[O:28][CH3:29])=[C:18]([CH3:25])[NH:19][c:20]4[n:21]3[cH:22][cH:23][n:24]4)[cH:13][cH:14][cH:15]2)[O:6][CH2:9][CH2:8][O:7]1.[OH2:3].[c:30]1([CH3:31])[cH:32][cH:33][c:34]([S:35]([OH:36])(=[O:37])=[O:38])[cH:39][cH:40]1>>[CH3:4][C:5](=[O:6])[c:10]1[cH:11][c:12]([CH:16]2[C:17]([C:26](=[O:27])[O:28][CH3:29])=[C:18]([CH3:25])[NH:19][c:20]3[n:21]2[cH:22][cH:23][n:24]3)[cH:13][cH:14][cH:15]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 887MethanolHCID 962WaterHCID 6101p-Toluenesulfonic acidHCID 13589523HCID 13589523, compound

Product 1

HCID 13589522HCID 13589522, compound

Sources & evidence

ORD record
ord-d7bde2f45f4e414abe8845f89543951a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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