Chloride → HCID 178522282, compound
Reaction equation
[CH2:52]1[O:53][CH2:54][CH2:55][CH2:56]1.[CH:35]([N:36]([CH:37]([CH3:38])[CH3:39])[CH2:40][CH3:41])([CH3:42])[CH3:43].[CH:45]1([C:49](=[O:50])[OH:51])[CH2:46][CH2:47][CH2:48]1.[Cl-:44].[ClH:1].[NH2:2][CH:3]1[CH:4]([OH:34])[CH:5]([OH:33])[CH:6]([n:8]2[c:9]3[n:10][c:11]([Cl:32])[n:12][c:13]([NH:17][CH2:18][CH:19]([c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[c:26]4[cH:27][cH:28][cH:29][cH:30][cH:31]4)[c:14]3[n:15][cH:16]2)[CH2:7]1>>[NH:2]([CH:3]1[CH:4]([OH:34])[CH:5]([OH:33])[CH:6]([n:8]2[c:9]3[n:10][c:11]([Cl:32])[n:12][c:13]([NH:17][CH2:18][CH:19]([c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[c:26]4[cH:27][cH:28][cH:29][cH:30][cH:31]4)[c:14]3[n:15][cH:16]2)[CH2:7]1)[C:49]([CH:45]1[CH2:46][CH2:47][CH2:48]1)=[O:50]Participants
7
Sources & evidence
- ORD record
- ord-a08b8d90af6b4d7d9438eabe65cfecae
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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