Acetic Acid → HCID 136335130, compound

HRID 1116853Notes

Reaction equation

HRID 1116853 reaction equation
[C:24]([OH:25])(=[O:26])[CH3:27].[CH2:28]1[O:29][CH2:30][CH2:31][CH2:32]1.[N:1](=[O:2])[O-:3].[Na+:4].[O:5]1[CH2:6][O:7][c:8]2[c:9]1[cH:10][cH:11][c:12]([C:14]([CH2:15][c:16]1[n:17][c:18]([CH3:22])[cH:19][cH:20][cH:21]1)=[O:23])[cH:13]2.[OH2:33]>>[N:1]([OH:3])=[C:15]([C:14]([c:12]1[cH:11][cH:10][c:9]2[c:8]([cH:13]1)[O:7][CH2:6][O:5]2)=[O:23])[c:16]1[n:17][c:18]([CH3:22])[cH:19][cH:20][cH:21]1

Participants

7

Sources & evidence

ORD record
ord-94332b05b86f4c50900bf688b598b0bc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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