Acetone → HCID 11225578, compound

HRID 207707Notes

Reaction equation

HRID 207707 reaction equation
[CH3:35][C:36]([CH3:37])=[O:38].[CH3:39][OH:40].[CH:1]12[N:2]([c:8]3[n:9][c:10](-[c:17]4[cH:18][c:19]([NH:23][CH2:24][c:25]5[cH:26][cH:27][cH:28][c:29]6[cH:30][cH:31][cH:32][cH:33][c:34]56)[n:20][cH:21][cH:22]4)[cH:11][c:12]4[n:13]3[cH:14][cH:15][n:16]4)[CH2:3][CH:4]([NH:5][CH2:6]1)[CH2:7]2.[CH:41]([Cl:42])([Cl:43])[Cl:44].[Cl:45][CH2:46][Cl:47]>>[CH:1]12[N:2]([c:8]3[n:9][c:10](-[c:17]4[cH:18][c:19]([NH:23][CH2:24][c:25]5[cH:26][cH:27][cH:28][c:29]6[cH:30][cH:31][cH:32][cH:33][c:34]56)[n:20][cH:21][cH:22]4)[cH:11][c:12]4[n:13]3[cH:14][cH:15][n:16]4)[CH2:3][CH:4]([N:5]([CH:36]([CH3:35])[CH3:37])[CH2:6]1)[CH2:7]2

Participants

6

Sources & evidence

ORD record
ord-db9fb0dda3914383ba0c06612a145080
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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