Acetic Acid → HCID 22137892, compound

HRID 1206835Notes

Reaction equation

HRID 1206835 reaction equation
[BH3:31].[CH3:1][C:2]([O:3][C:4](=[O:5])[CH3:6])=[O:7].[CH3:28][S:29][CH3:30].[CH3:38][OH:39].[CH3:8][C:9](=[O:10])[OH:11].[ClH:32].[F:12][c:13]1[cH:14][c:15]([CH2:16][O:17][c:18]2[cH:19][cH:20][c:21]([NH2:24])[cH:22][cH:23]2)[cH:25][cH:26][cH:27]1.[O:33]1[CH2:34][CH2:35][CH2:36][CH2:37]1>>[CH3:1][NH:24][c:21]1[cH:20][cH:19][c:18]([O:17][CH2:16][c:15]2[cH:14][c:13]([F:12])[cH:27][cH:26][cH:25]2)[cH:23][cH:22]1

Participants

9

Sources & evidence

ORD record
ord-f8dea71337464724816ef679116ed901
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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