Hydrochloric Acid → HCID 178450128, compound

HRID 96891Notes

Reaction equation

HRID 96891 reaction equation
[C:50](=[O:51])([O-:52])[OH:53].[CH3:55][OH:56].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([C:14]([CH:15]([CH3:16])[CH3:17])([OH:18])[c:19]3[n:20][cH:21][n:22]([C:24]([c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)([c:31]4[cH:32][cH:33][cH:34][cH:35][cH:36]4)[c:37]4[cH:38][cH:39][cH:40][cH:41][cH:42]4)[cH:23]3)[cH:11][cH:12][cH:13]2)[cH:6][cH:7]1.[ClH:43].[Na+:54].[n:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([C:14]([CH:15]([CH3:16])[CH3:17])([OH:18])[c:19]3[n:20][cH:21][nH:22][cH:23]3)[cH:11][cH:12][cH:13]2)[cH:6][cH:7]1

Participants

7

Sources & evidence

ORD record
ord-cf950605c7814f109ca05829f0aea14a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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