Levulinic Acid → HCID 53737588, compound

HRID 664596Notes

Reaction equation

HRID 664596 reaction equation
[C:10]([OH:11])(=[O:12])[CH2:13][CH2:14][C:15]([CH3:16])=[O:17].[CH3:1][CH:2]([CH2:3][C:4]([CH3:5])=[O:6])[C:7]([OH:8])=[O:9].[n:18]1(-[c:23]2[cH:24][cH:25][c:26]([CH:29]=[CH:30][C:31]([CH:32]([CH2:33][C:34](=[O:35])[OH:36])[CH3:37])=[O:38])[cH:27][cH:28]2)[cH:19][n:20][cH:21][cH:22]1>>[n:18]1(-[c:23]2[cH:24][cH:25][c:26]([CH:29]=[CH:30][C:31]([CH2:32][CH2:33][C:34](=[O:35])[OH:36])=[O:38])[cH:27][cH:28]2)[cH:19][n:20][cH:21][cH:22]1

Participants

4

Reactant 3

HCID 11579Levulinic AcidHCID 2259022-Methyl-4-oxopentanoic acidHCID 53949648HCID 53949648, compound

Product 1

HCID 53737588HCID 53737588, compound

Sources & evidence

ORD record
ord-add0899b6b184cc8885b4030739d7c7d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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