Ethanol → HCID 18440366, compound

HRID 1545528Notes

Reaction equation

HRID 1545528 reaction equation
[CH3:25][CH2:26][OH:27].[Na+:24].[OH-:23].[c:1]1([CH2:7][CH2:8][O:9][c:10]2[n:11][c:12]([NH2:22])[c:13]3[n:14][c:15]([Br:21])[n:16]([CH2:19][CH3:20])[c:17]3[n:18]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][CH2:8][O:9][c:10]2[n:11][c:12]([NH2:22])[c:13]3[n:14][c:15]([O:27][CH2:26][CH3:25])[n:16]([CH2:19][CH3:20])[c:17]3[n:18]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

5

Sources & evidence

ORD record
ord-277b7c45a3e74263a4e99a4165e7d5da
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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