Acetone → HCID 18354482, compound

HRID 312170Notes

Reaction equation

HRID 312170 reaction equation
[C:32]([CH3:33])([CH3:34])([CH3:35])[OH:36].[CH3:1][N:2]([C:3]([c:4]1[c:5]([O:15][CH3:16])[cH:6][cH:7][c:8](-[n:10]2[n:11][n:12][n:13][cH:14]2)[cH:9]1)=[O:17])[CH2:18][CH:19]([CH2:20][CH:21]=[CH2:22])[c:23]1[cH:24][c:25]([Cl:30])[c:26]([Cl:29])[cH:27][cH:28]1.[CH3:37][C:38]([CH3:39])=[O:40].[CH3:41][N+:42]1([O-:48])[CH2:43][CH2:44][O:45][CH2:46][CH2:47]1.[Na+:54].[Na+:55].[O:62]1[CH2:63][CH2:64][CH2:65][CH2:66]1.[OH2:31].[OH2:61].[Os:56](=[O:57])(=[O:58])(=[O:59])=[O:60].[S:49]([O-:50])([O-:51])(=[O:52])=[S:53]>>[CH3:1][N:2]([C:3]([c:4]1[c:5]([O:15][CH3:16])[cH:6][cH:7][c:8](-[n:10]2[n:11][n:12][n:13][cH:14]2)[cH:9]1)=[O:17])[CH2:18][CH:19]([CH2:20][CH:21]=[O:36])[c:23]1[cH:24][c:25]([Cl:30])[c:26]([Cl:29])[cH:27][cH:28]1

Participants

10

Sources & evidence

ORD record
ord-084c1e72fe0d46fb8ca0ce2e2be4d614
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…