Ethanol → HCID 44227315, compound

HRID 2320602Notes

Reaction equation

HRID 2320602 reaction equation
[CH3:45][CH2:46][OH:47].[CH:1]1([CH2:4][O:5][c:6]2[cH:7][cH:8][c:9]3[c:10]([c:11]([CH3:36])[c:12]([CH:14]([CH:15]([CH3:16])[CH3:17])[NH:18][c:19]4[cH:20][cH:21][c:22]([C:25](=[O:26])[N:27]([CH2:28][CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[CH3:35])[cH:23][cH:24]4)[o:13]3)[cH:37]2)[CH2:2][CH2:3]1.[Na+:39].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[OH-:38]>>[CH:1]1([CH2:4][O:5][c:6]2[cH:7][cH:8][c:9]3[c:10]([c:11]([CH3:36])[c:12]([CH:14]([CH:15]([CH3:16])[CH3:17])[NH:18][c:19]4[cH:20][cH:21][c:22]([C:25](=[O:26])[N:27]([CH2:28][CH2:29][C:30](=[O:31])[OH:32])[CH3:35])[cH:23][cH:24]4)[o:13]3)[cH:37]2)[CH2:2][CH2:3]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 66777593HCID 66777593, compound

Product 1

HCID 44227315HCID 44227315, compound

Sources & evidence

ORD record
ord-17353d4bf5604ebe8232e122509198ed
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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