Acetic Acid → HCID 13500543, compound

HRID 1146474Notes

Reaction equation

HRID 1146474 reaction equation
[BH4-:29].[CH3:1][O:2][c:3]1[cH:4][c:5]([C:11]2=[N:12][N:13]=[C:14]([CH3:28])[CH:15]([CH2:26][CH3:27])[c:16]3[c:17]2[cH:18][c:19]([O:24][CH3:25])[c:20]([O:22][CH3:23])[cH:21]3)[cH:6][cH:7][c:8]1[O:9][CH3:10].[CH3:31][C:32](=[O:33])[OH:34].[Na+:30].[OH2:35]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:11]2=[N:12][NH:13][CH:14]([CH3:28])[CH:15]([CH2:26][CH3:27])[c:16]3[c:17]2[cH:18][c:19]([O:24][CH3:25])[c:20]([O:22][CH3:23])[cH:21]3)[cH:6][cH:7][c:8]1[O:9][CH3:10]

Participants

6

Sources & evidence

ORD record
ord-94d76572b3634a4a99d9632ef7f210ba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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