Acetic Acid → HCID 22760700, compound

HRID 1547128Notes

Reaction equation

HRID 1547128 reaction equation
[CH3:35][C:36](=[O:37])[OH:38].[H:33][H:34].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH2:8][N:9]2[CH2:10][CH2:11][N:12]([c:15]3[n:16][cH:17][c:18]4[c:19]([n:20]3)[n:21]([CH2:29][CH3:30])[cH:22][c:23]([C:26](=[O:27])[OH:28])[c:24]4=[O:25])[CH2:13][CH2:14]2)[cH:31][cH:32]1>>[NH2:1][c:4]1[cH:5][cH:6][c:7]([CH2:8][N:9]2[CH2:10][CH2:11][N:12]([c:15]3[n:16][cH:17][c:18]4[c:19]([n:20]3)[n:21]([CH2:29][CH3:30])[cH:22][c:23]([C:26](=[O:27])[OH:28])[c:24]4=[O:25])[CH2:13][CH2:14]2)[cH:31][cH:32]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 22760701HCID 22760701, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 22760700HCID 22760700, compound

Sources & evidence

ORD record
ord-bafb06186d3c41a49f15c15bc9219917
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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