Ethanol → HCID 23283374, compound

HRID 1219992Notes

Reaction equation

HRID 1219992 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9]([CH:10]([NH:11][c:12]1[cH:13][cH:14][c:15]([C:18]#[N:19])[cH:16][cH:17]1)[c:20]1[c:21]([N+:36]([O-:37])=[O:38])[cH:22][c:23]([O:28][CH2:29][c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:24]([O:26][CH3:27])[cH:25]1)=[O:39].[CH3:40][CH2:41][O:42][C:43]([CH3:44])=[O:45].[CH3:46][CH2:47][OH:48]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9]([CH:10]([NH:11][c:12]1[cH:13][cH:14][c:15]([C:18]#[N:19])[cH:16][cH:17]1)[c:20]1[c:21]([NH2:36])[cH:22][c:23]([O:28][CH2:29][c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:24]([O:26][CH3:27])[cH:25]1)=[O:39]

Participants

4

Reactant 3

HCID 702EthanolHCID 8857Ethyl AcetateHCID 15410798HCID 15410798, compound

Product 1

HCID 23283374HCID 23283374, compound

Sources & evidence

ORD record
ord-ccb5b56b7931438cb280da9ded97c596
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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