Trimethylamine → HCID 18001119, compound

HRID 697091Notes

Reaction equation

HRID 697091 reaction equation
[CH3:40][N:41]([CH3:42])[CH3:43].[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[OH:1][c:2]1[c:3]([NH:19][C:20]([c:21]2[cH:22][cH:23][c:24]([N:27]3[CH2:28][CH2:29][N:30]([CH3:34])[CH2:31][CH2:32][CH2:33]3)[cH:25][cH:26]2)=[O:35])[c:4]([NH:8][C:9]([c:10]2[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)=[O:18])[cH:5][cH:6][cH:7]1.[S:36](=[O:37])(=[O:38])=[O:39]>>[O:1]([c:2]1[c:3]([NH:19][C:20]([c:21]2[cH:22][cH:23][c:24]([N:27]3[CH2:28][CH2:29][N:30]([CH3:34])[CH2:31][CH2:32][CH2:33]3)[cH:25][cH:26]2)=[O:35])[c:4]([NH:8][C:9]([c:10]2[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)=[O:18])[cH:5][cH:6][cH:7]1)[S:36](=[O:37])(=[O:38])[OH:39]

Participants

5

Sources & evidence

ORD record
ord-1dbcdafe13d64015a9669d2d34080de4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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