Hydrochloric Acid → HCID 178524676, compound
Reaction equation
[CH2:55]1[O:56][CH2:57][CH2:58][CH2:59]1.[CH:1]1([N:2]=[C:3]=[N:4][CH:5]2[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]2)[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]1.[ClH:27].[F:28][c:29]1[c:30]([NH:35][CH:36]([C:37](=[O:38])[OH:39])[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:31][cH:32][cH:33][cH:34]1.[N:46]12[CH2:47][CH:48]([OH:54])[CH:49]([CH2:50][CH2:51]1)[CH2:52][CH2:53]2.[OH2:16].[n:17]1([OH:18])[c:19]2[cH:20][cH:21][cH:22][cH:23][c:24]2[n:25][n:26]1>>[F:28][c:29]1[c:30]([NH:35][CH:36]([C:37]([O:38][CH:48]2[CH2:47][N:46]3[CH2:51][CH2:50][CH:49]2[CH2:52][CH2:53]3)=[O:39])[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:31][cH:32][cH:33][cH:34]1Participants
8
Sources & evidence
- ORD record
- ord-9a13766d95fc4864959003ee0f288138
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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