Acetone → HCID 178516229, compound

HRID 1561979Notes

Reaction equation

HRID 1561979 reaction equation
[C:40](=[O:41])([OH:42])[O-:43].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]1[C:13](=[O:27])[N:14]([CH:17]2[CH2:18][CH2:19][C:20]3([O:21][CH2:24][CH2:23][O:22]3)[CH2:25][CH2:26]2)[CH2:15][CH2:16]1.[CH3:45][C:46](=[O:47])[CH3:48].[ClH:39].[Na+:44].[c:28]1([CH3:29])[cH:30][cH:31][c:32]([S:33]([OH:34])(=[O:35])=[O:36])[cH:37][cH:38]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]1[C:13](=[O:27])[N:14]([CH:17]2[CH2:18][CH2:19][C:20](=[O:21])[CH2:25][CH2:26]2)[CH2:15][CH2:16]1

Participants

7

Reactant 6

HCID 180AcetoneHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 6101p-Toluenesulfonic acidHCID 178522284HCID 178522284, compound

Product 1

HCID 178516229HCID 178516229, compound

Sources & evidence

ORD record
ord-691e964a97524b5ea58a11bcd9dcc103
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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