Hydrochloric Acid → HCID 57871407, compound
Reaction equation
[CH2:36]([CH3:37])[C:38]([CH2:39][CH3:40])([c:41]1[cH:42][c:43]([CH3:57])[c:44]([O:47][CH:48]([CH:49]([C:50]([CH3:51])([CH3:52])[CH3:53])[OH:54])[CH2:55][CH3:56])[cH:45][cH:46]1)[c:58]1[cH:59][c:60]2[cH:61][cH:62][c:63]([C:68](=[O:69])[OH:70])[cH:64][c:65]2[cH:66][cH:67]1.[CH3:18][CH2:19][N:20]=[C:21]=[N:22][CH2:23][CH2:24][CH2:25][N:26]([CH3:27])[CH3:28].[CH3:29][CH2:30][N:31]([CH2:32][CH3:33])[CH2:34][CH3:35].[CH3:2][O:3][C:4]([CH2:5][NH2:6])=[O:7].[Cl:71][CH2:72][Cl:73].[ClH:1].[OH:8][n:9]1[c:10]2[c:11]([cH:12][cH:13][cH:14][cH:15]2)[n:16][n:17]1>>[CH3:2][O:3][C:4]([CH2:5][NH:6][C:68]([c:63]1[cH:62][cH:61][c:60]2[cH:59][c:58]([C:38]([CH2:36][CH3:37])([CH2:39][CH3:40])[c:41]3[cH:42][c:43]([CH3:57])[c:44]([O:47][CH:48]([CH:49]([C:50]([CH3:51])([CH3:52])[CH3:53])[OH:54])[CH2:55][CH3:56])[cH:45][cH:46]3)[cH:67][cH:66][c:65]2[cH:64]1)=[O:69])=[O:7]Participants
8
Sources & evidence
- ORD record
- ord-705bc44ca459431396eaa3c147f7a00a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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