Acetone → HCID 178426900, compound

HRID 93684Notes

Reaction equation

HRID 93684 reaction equation
[CH3:1][O:2][C:3]([CH:4]([CH2:5][OH:6])[NH:7][C:8](=[O:9])[c:10]1[cH:11][cH:12][c:13]2[n:19]1[CH2:18][c:17]1[c:16]([cH:23][cH:22][cH:21][cH:20]1)[N:15]([C:24]([c:25]1[cH:26][c:27]([CH3:37])[c:28]([C:31]3=[CH:32][CH2:33][CH2:34][CH2:35][CH2:36]3)[cH:29][cH:30]1)=[O:38])[CH2:14]2)=[O:39].[CH3:43][C:44](=[O:45])[CH3:46].[ClH:42].[Na+:41].[OH-:40]>>[O:2]=[C:3]([CH:4]([CH2:5][OH:6])[NH:7][C:8](=[O:9])[c:10]1[cH:11][cH:12][c:13]2[n:19]1[CH2:18][c:17]1[c:16]([cH:23][cH:22][cH:21][cH:20]1)[N:15]([C:24]([c:25]1[cH:26][c:27]([CH3:37])[c:28]([C:31]3=[CH:32][CH2:33][CH2:34][CH2:35][CH2:36]3)[cH:29][cH:30]1)=[O:38])[CH2:14]2)[OH:39]

Participants

6

Sources & evidence

ORD record
ord-3fb90fcfee7647cc9a3423227a2b1d51
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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