Acetic Acid → HCID 490485, compound

HRID 207772Notes

Reaction equation

HRID 207772 reaction equation
[CH3:28][C:29](=[O:30])[OH:31].[CH3:32][OH:33].[NH2:1][n:2]1[cH:3][c:4]([C:17](=[O:18])[NH:19][CH2:20][c:21]2[cH:22][cH:23][c:24]([Cl:27])[cH:25][cH:26]2)[c:5](=[O:16])[c:6]2[cH:7][c:8]([C:12]#[C:13][CH2:14][OH:15])[cH:9][cH:10][c:11]12.[O:34]=[CH:35][N:36]([CH3:37])[CH3:38]>>[NH2:1][n:2]1[cH:3][c:4]([C:17](=[O:18])[NH:19][CH2:20][c:21]2[cH:22][cH:23][c:24]([Cl:27])[cH:25][cH:26]2)[c:5](=[O:16])[c:6]2[cH:7][c:8]([CH2:12][CH2:13][CH2:14][OH:15])[cH:9][cH:10][c:11]12

Participants

5

Sources & evidence

ORD record
ord-e801626778f0406da2409a7a125cf989
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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