Hydrochloric Acid → HCID 11489661, compound
Reaction equation
[CH:1]1([CH2:11][N:12]2[CH2:13][CH2:14][CH:15]([NH:18][C:19](=[O:20])[c:21]3[nH:22][c:23]4[cH:24][cH:25][cH:26][c:27]([O:30][CH2:31][c:32]5[cH:33][o:34][c:35]6[c:36]5[c:37]([O:41][CH3:42])[cH:38][cH:39][cH:40]6)[c:28]4[cH:29]3)[CH2:16][CH2:17]2)[CH:2]2[N:3]([CH2:4][CH2:5][CH2:6][CH2:7]2)[CH2:8][CH2:9][CH2:10]1.[ClH:43].[ClH:44].[ClH:45].[NH2:46][CH:47]1[CH2:48][CH2:49][N:50]([CH2:51][CH2:52][N:55]2[CH2:56][CH2:57][CH:58]([OH:61])[CH2:59][CH2:60]2)[CH2:53][CH2:54]1>>[CH2:1]([CH2:11][N:12]1[CH2:13][CH2:14][CH:15]([NH:18][C:19](=[O:20])[c:21]2[nH:22][c:23]3[cH:24][cH:25][cH:26][c:27]([O:30][CH2:31][c:32]4[cH:33][o:34][c:35]5[c:36]4[c:37]([O:41][CH3:42])[cH:38][cH:39][cH:40]5)[c:28]3[cH:29]2)[CH2:16][CH2:17]1)[N:55]1[CH2:56][CH2:57][CH:58]([OH:61])[CH2:59][CH2:60]1Participants
4
Sources & evidence
- ORD record
- ord-bfd586c97d064fa2a7708927c25fd573
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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