Hydrochloric Acid → HCID 58608133, compound

HRID 1119881Notes

Reaction equation

HRID 1119881 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][NH:16][c:17]2[c:18]3[c:19]([n:20][cH:21][cH:22]2)[o:23][c:24](-[c:32]2[cH:33][cH:34][c:35]([OH:38])[cH:36][cH:37]2)[c:25]3-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[CH2:12][CH2:13]1.[C:50](=[O:51])([O-:52])[O-:53].[CH:40]([CH3:41])([CH3:42])[N:43]([CH2:44][CH2:45][Cl:46])[CH:47]([CH3:48])[CH3:49].[ClH:39].[Cs+:54].[Cs+:55].[O:56]=[CH:57][N:58]([CH3:59])[CH3:60]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][NH:16][c:17]2[c:18]3[c:19]([n:20][cH:21][cH:22]2)[o:23][c:24](-[c:32]2[cH:33][cH:34][c:35]([O:38][CH2:45][CH2:44][N:43]([CH:40]([CH3:41])[CH3:42])[CH:47]([CH3:48])[CH3:49])[cH:36][cH:37]2)[c:25]3-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[CH2:12][CH2:13]1

Participants

7

Sources & evidence

ORD record
ord-e911d264502549c8aaf6637245d94ae0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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