Ethanol → HCID 13560551, compound

HRID 310052Notes

Reaction equation

HRID 310052 reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][NH:7][C:8](=[O:9])[CH2:10][c:11]1[cH:12][c:13]([O:19][CH3:20])[c:14]([O:17][CH3:18])[cH:15][cH:16]1)[c:21]1[cH:22][c:23]([O:29][CH3:30])[c:24]([O:27][CH3:28])[cH:25][cH:26]1)=[O:31].[CH3:34][CH2:35][OH:36].[Na+:33].[OH-:32]>>[O:3]=[C:4]([CH:5]([CH2:6][NH:7][C:8](=[O:9])[CH2:10][c:11]1[cH:12][c:13]([O:19][CH3:20])[c:14]([O:17][CH3:18])[cH:15][cH:16]1)[c:21]1[cH:22][c:23]([O:29][CH3:30])[c:24]([O:27][CH3:28])[cH:25][cH:26]1)[OH:31]

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 135605252-(3,4-Dimethoxyphenyl)-3-{{[(3,4-dimethoxyphenyl)methyl]carbonyl}amino}propanoic acid ethyl ester

Product 1

HCID 13560551HCID 13560551, compound

Sources & evidence

ORD record
ord-687813def5b44b18b0ae3cdd7c45ebf5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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