Acetic Acid → HCID 67703563, compound

HRID 1561766Notes

Reaction equation

HRID 1561766 reaction equation
[C:38](=[O:39])([OH:40])[O-:41].[CH3:1][C:2]1([c:7]2[cH:8][cH:9][c:10]([CH2:13][CH2:14][CH2:15][O:16][c:17]3[c:18]([CH3:33])[cH:19][c:20]([N:24]4[O:25][C:26]([C:29]([F:30])([F:31])[F:32])=[N:27][CH2:28]4)[cH:21][c:22]3[CH3:23])[n:11][n:12]2)[O:3][CH2:6][CH2:5][O:4]1.[CH3:34][C:35](=[O:36])[OH:37].[Na+:42].[OH2:43]>>[CH3:1][C:2](=[O:3])[c:7]1[cH:8][cH:9][c:10]([CH2:13][CH2:14][CH2:15][O:16][c:17]2[c:18]([CH3:33])[cH:19][c:20]([N:24]3[O:25][C:26]([C:29]([F:30])([F:31])[F:32])=[N:27][CH2:28]3)[cH:21][c:22]2[CH3:23])[n:11][n:12]1

Participants

6

Sources & evidence

ORD record
ord-7264af7ca20a4f4f8b2aa8751251118c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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