Acetic Acid → HCID 58724420, compound

HRID 115019Notes

Reaction equation

HRID 115019 reaction equation
[CH3:39][C:40](=[O:41])[OH:42].[O:34]=[CH:35][N:36]([CH3:37])[CH3:38].[nH:1]1[c:2]([NH:6][C:7](=[O:8])[c:9]2[cH:10][c:11]([N+:31]([O-:32])=[O:33])[cH:12][c:13]3[nH:14][c:15]([NH:18][C:19](=[O:20])[c:21]4[n:22][cH:23][c:24]5[cH:25][cH:26][cH:27][cH:28][c:29]5[cH:30]4)[n:16][c:17]23)[n:3][cH:4][cH:5]1>>[n:1]1[c:2]([NH:6][C:7](=[O:8])[c:9]2[cH:10][c:11]([NH2:31])[cH:12][c:13]3[nH:14][c:15]([NH:18][C:19](=[O:20])[c:21]4[n:22][cH:23][c:24]5[cH:25][cH:26][cH:27][cH:28][c:29]5[cH:30]4)[n:16][c:17]23)[nH:3][cH:4][cH:5]1

Participants

4

Sources & evidence

ORD record
ord-240f7c8677294ffbb61b0c087242a88b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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