Acetic Acid → HCID 69016591, compound

HRID 124311Notes

Reaction equation

HRID 124311 reaction equation
[C:24]([BH3-:25])#[N:26].[C:28]([OH:29])(=[O:30])[CH3:31].[CH2:22]=[O:23].[CH3:32][C:33]#[N:34].[NH:1]1[CH:2]([CH2:6][O:7][c:8]2[cH:9][c:10]([NH:18][C:19]([CH3:20])=[O:21])[cH:11][cH:12][c:13]2[C:14]([F:15])([F:16])[F:17])[CH2:3][CH2:4][CH2:5]1.[Na+:27]>>[N:1]1([CH3:24])[CH:2]([CH2:6][O:7][c:8]2[cH:9][c:10]([NH:18][C:19]([CH3:20])=[O:21])[cH:11][cH:12][c:13]2[C:14]([F:15])([F:16])[F:17])[CH2:3][CH2:4][CH2:5]1

Participants

7

Sources & evidence

ORD record
ord-afea390ddd1c4351a80da1c496e9507e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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