Acetate → HCID 178468348, compound

HRID 2320351Notes

Reaction equation

HRID 2320351 reaction equation
[C:39](=[O:40])([O-:41])[O-:42].[CH3:27][C:28]([CH2:29][C:30]([CH3:31])=[O:32])=[O:33].[CH3:35][C:36](=[O:37])[O-:38].[CH3:45][CH2:46][OH:47].[K+:34].[N:1]1([c:7]2[cH:8][cH:9][c:10]([NH2:11])[cH:12][cH:13]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[N:23]([O-:24])=[O:25].[Na+:26].[Na+:43].[Na+:44].[OH:19][N+:20](=[O:21])[O-:22].[P:14](=[O:15])([OH:16])([OH:17])[OH:18]>>[N:1]1([c:7]2[cH:8][cH:9][c:10]([NH:11][N:23]=[C:29]([C:28]([CH3:27])=[O:33])[C:30]([CH3:31])=[O:32])[cH:12][cH:13]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

11

Reactant 10

HCID 175AcetateHCID 702EthanolHCID 813Potassium CationHCID 923Sodium ion3×HCID 944Nitric AcidHCID 946NitriteHCID 1004Phosphoric AcidHCID 19660Carbonate IonHCID 31261AcetylacetoneHCID 4135014-(Piperidin-1-yl)aniline

Product 1

HCID 178468348HCID 178468348, compound

Sources & evidence

ORD record
ord-1bd3d6bc3c824500ada15ca0de0783d4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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