Acetic Acid → HCID 21034922, compound

HRID 689408Notes

Reaction equation

HRID 689408 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][n:8][c:9]([CH2:20][c:21]2[cH:22][c:23]([O:27][CH3:28])[cH:24][cH:25][cH:26]2)[c:10]2[cH:11][c:12]([O:18][CH3:19])[c:13]([O:16][CH3:17])[cH:14][c:15]12.[CH3:29][O:30][c:31]1[cH:32][c:33]2[c:34]([cH:35][c:36]1[O:37][CH3:38])[c:39]([C:40](=[O:41])[c:42]1[cH:43][cH:44][cH:45][c:46]([O:47][CH3:48])[cH:49]1)[n:50][cH:51][c:52]2[CH2:53][C:54]([OH:55])=[O:56].[CH3:60][C:61](=[O:62])[OH:63].[Se:57](=[O:58])=[O:59]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][n:8][c:9]([C:20]([c:21]2[cH:22][c:23]([O:27][CH3:28])[cH:24][cH:25][cH:26]2)=[O:30])[c:10]2[cH:11][c:12]([O:18][CH3:19])[c:13]([O:16][CH3:17])[cH:14][c:15]12

Participants

5

Sources & evidence

ORD record
ord-39fb100c11d4420693bf81974f2d8d80
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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