Acetic Acid → HCID 22762560, compound

HRID 281313Notes

Reaction equation

HRID 281313 reaction equation
[CH3:30][C:31](=[O:32])[OH:33].[H:28][H:29].[c:1]1(-[c:7]2[cH:8][n:9][c:10]([CH2:12][N:13]3[CH2:14][CH2:15][N:16]([c:19]4[cH:20][cH:21][c:22]([N+:25]([O-:26])=[O:27])[cH:23][cH:24]4)[CH2:17][CH2:18]3)[o:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:7]2[cH:8][n:9][c:10]([CH2:12][N:13]3[CH2:14][CH2:15][N:16]([c:19]4[cH:20][cH:21][c:22]([NH2:25])[cH:23][cH:24]4)[CH2:17][CH2:18]3)[o:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 8590733HCID 8590733, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 22762560HCID 22762560, compound

Sources & evidence

ORD record
ord-be937fc043444161aee90a84374682c5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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