Hydrochloric Acid → HCID 57597385, compound
Reaction equation
[CH2:56]([N:57]=[C:58]=[N:59][CH2:60][CH2:61][CH2:62][N:63]([CH3:64])[CH3:65])[CH3:66].[CH3:67][N:68]([CH3:69])[CH:70]=[O:71].[CH3:72][CH2:73][N:74]([CH2:75][CH3:76])[CH2:77][CH3:78].[Cl:1][c:2]1[cH:3][c:4]([NH:17][c:18]2[c:19]3[c:20]([n:21][cH:22][n:23]2)[cH:24][cH:25][n:26]3[CH2:27][c:28]2[cH:29][cH:30][c:31]([C:32](=[O:33])[OH:34])[cH:35][cH:36]2)[cH:5][cH:6][c:7]1[O:8][CH2:9][c:10]1[cH:11][c:12]([F:16])[cH:13][cH:14][cH:15]1.[ClH:55].[OH2:44].[OH:37][CH:38]1[CH2:39][CH2:40][NH:41][CH2:42][CH2:43]1.[OH:45][n:46]1[c:47]2[cH:48][cH:49][cH:50][cH:51][c:52]2[n:53][n:54]1>>[Cl:1][c:2]1[cH:3][c:4]([NH:17][c:18]2[c:19]3[c:20]([n:21][cH:22][n:23]2)[cH:24][cH:25][n:26]3[CH2:27][c:28]2[cH:29][cH:30][c:31]([C:32](=[O:34])[N:41]3[CH2:40][CH2:39][CH:38]([OH:37])[CH2:43][CH2:42]3)[cH:35][cH:36]2)[cH:5][cH:6][c:7]1[O:8][CH2:9][c:10]1[cH:11][c:12]([F:16])[cH:13][cH:14][cH:15]1Participants
9
Sources & evidence
- ORD record
- ord-17c77f74e45c4b2dba26cd2b778a7ea8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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