Ethanol → HCID 66777634, compound

HRID 94774Notes

Reaction equation

HRID 94774 reaction equation
[CH3:1][O:2][CH2:3][CH2:4][CH2:5][CH2:6][CH:7]([c:8]1[o:9][c:10]2[c:11]([c:12]1[CH3:13])[cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)[NH:20][c:21]1[cH:22][cH:23][c:24]([C:27](=[O:28])[N:29]([CH2:30][CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[CH3:37])[cH:25][cH:26]1.[CH3:45][CH2:46][OH:47].[Na+:44].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1.[OH-:43]>>[CH3:1][O:2][CH2:3][CH2:4][CH2:5][CH2:6][CH:7]([c:8]1[o:9][c:10]2[c:11]([c:12]1[CH3:13])[cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)[NH:20][c:21]1[cH:22][cH:23][c:24]([C:27](=[O:28])[N:29]([CH2:30][CH2:31][C:32](=[O:33])[OH:34])[CH3:37])[cH:25][cH:26]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 66778459Ethyl 3-{[(4-{[5-methoxy-1-(5-methoxy-3-methyl-1-benzofuran-2-yl)pentyl]amino}phenyl)carbonyl](methyl)amino}propanoate

Product 1

HCID 66777634HCID 66777634, compound

Sources & evidence

ORD record
ord-c451f55a3e2242afa309bf5fdb960a5d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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