Acetic Acid → HCID 23529053, compound

HRID 2154201Notes

Reaction equation

HRID 2154201 reaction equation
[C:4]([CH3:5])(=[O:6])[NH:7][CH2:8][CH:9]1[CH2:10][N:11]([c:15]2[cH:16][c:17]([F:39])[c:18]([C:21]3=[N:26][NH:25][C:24](=[O:27])[CH:23]([c:28]4[cH:29][cH:30][c:31]([O:34][S:35]([CH3:36])(=[O:37])=[O:38])[cH:32][cH:33]4)[S:22]3)[cH:19][cH:20]2)[C:12](=[O:14])[O:13]1.[CH3:1][O-:2].[CH3:40][C:41](=[O:42])[OH:43].[CH3:44][OH:45].[Na+:3]>>[C:4]([CH3:5])(=[O:6])[NH:7][CH2:8][CH:9]1[CH2:10][N:11]([c:15]2[cH:16][c:17]([F:39])[c:18]([C:21]3=[N:26][NH:25][C:24](=[O:27])[CH:23]([c:28]4[cH:29][cH:30][c:31]([OH:34])[cH:32][cH:33]4)[S:22]3)[cH:19][cH:20]2)[C:12](=[O:14])[O:13]1

Participants

6

Sources & evidence

ORD record
ord-8f5dbff7795d40438dfcef4bcd86b70d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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