Acetic Acid → HCID 67038217, compound

HRID 207105Notes

Reaction equation

HRID 207105 reaction equation
[C:28]([O:29][BH-:30]([O:31][C:32](=[O:33])[CH3:34])[O:35][C:36](=[O:37])[CH3:38])(=[O:39])[CH3:40].[CH3:1][S:2](=[O:3])(=[O:4])[NH:5][c:6]1[cH:7][cH:8][c:9]([O:10][c:11]2[cH:12][cH:13][c:14]([CH:15]=[O:16])[cH:17][cH:18]2)[cH:19][cH:20]1.[CH3:49][C:50](=[O:51])[OH:52].[Na+:41].[Na+:43].[O:44]=[CH:45][N:46]([CH3:47])[CH3:48].[OH-:42].[OH:21][CH:22]1[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]1>>[CH3:1][S:2](=[O:3])(=[O:4])[NH:5][c:6]1[cH:7][cH:8][c:9]([O:10][c:11]2[cH:12][cH:13][c:14]([CH2:15][N:25]3[CH2:24][CH2:23][CH:22]([OH:21])[CH2:27][CH2:26]3)[cH:17][cH:18]2)[cH:19][cH:20]1

Participants

8

Sources & evidence

ORD record
ord-d8a07e1f9bf04dc6bcd55bec85a28bf6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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