Ethanol → HCID 11965020, compound

HRID 675604Notes

Reaction equation

HRID 675604 reaction equation
[CH3:33][CH2:34][OH:35].[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[CH3:5][c:6]1[cH:7][c:8]([NH:13][C:14](=[O:15])[c:16]2[c:17]([S:22][CH2:23][c:24]3[n:25][c:26]([S:30]([CH3:31])=[O:32])[n:27][cH:28][cH:29]3)[n:18][cH:19][cH:20][cH:21]2)[cH:9][c:10]([CH3:12])[cH:11]1.[CH:1]1([NH2:4])[CH2:2][CH2:3]1>>[CH:1]1([NH:4][c:26]2[n:25][c:24]([CH2:23][S:22][c:17]3[c:16]([C:14]([NH:13][c:8]4[cH:7][c:6]([CH3:5])[cH:11][c:10]([CH3:12])[cH:9]4)=[O:15])[cH:21][cH:20][cH:19][n:18]3)[cH:29][cH:28][n:27]2)[CH2:2][CH2:3]1

Participants

5

Reactant 4

HCID 702EthanolHCID 8857Ethyl AcetateHCID 69828CyclopropylamineHCID 67161373HCID 67161373, compound

Product 1

HCID 11965020HCID 11965020, compound

Sources & evidence

ORD record
ord-e6d32f4943c540eeab35aa453332a4f2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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