Hydrochloric Acid → HCID 10676857, compound

HRID 2145348Notes

Reaction equation

HRID 2145348 reaction equation
[C:1]([O-:2])([O-:3])=[O:4].[CH3:56][OH:57].[CH3:7][O:8][C:9]([CH:10]([CH2:11][CH2:12][N:13]1[C:14](=[O:23])[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]2[C:21]1=[O:22])[O:24][c:25]1[c:26]([Br:54])[cH:27][c:28](-[c:32]2[cH:33][cH:34][c:35](-[c:38]3[c:39]4[c:40]([s:41][c:42]3[CH2:43][c:44]3[cH:45][cH:46][cH:47][cH:48][cH:49]3)[cH:50][cH:51][cH:52][cH:53]4)[cH:36][cH:37]2)[cH:29][c:30]1[Br:31])=[O:55].[ClH:58].[K+:5].[K+:6].[OH2:59]>>[C:1]([OH:3])(=[O:4])[c:20]1[c:15]([C:14]([NH:13][CH2:12][CH2:11][CH:10]([C:9]([O:8][CH3:7])=[O:55])[O:24][c:25]2[c:26]([Br:54])[cH:27][c:28](-[c:32]3[cH:33][cH:34][c:35](-[c:38]4[c:39]5[c:40]([s:41][c:42]4[CH2:43][c:44]4[cH:45][cH:46][cH:47][cH:48][cH:49]4)[cH:50][cH:51][cH:52][cH:53]5)[cH:36][cH:37]3)[cH:29][c:30]2[Br:31])=[O:23])[cH:16][cH:17][cH:18][cH:19]1

Participants

7

Sources & evidence

ORD record
ord-84c064defa9d44c6962c89a0aaccc57d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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