Dichloromethane → HCID 178444670, compound
Reaction equation
[C:34]12([C:44](=[O:45])[Cl:46])[CH2:35][CH:36]3[CH2:37][CH:38]([CH2:39][CH:40]([CH2:41]1)[CH2:42]3)[CH2:43]2.[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[Cl:47][CH2:48][Cl:49].[NH2:1][CH:2]([CH2:3][N:4]1[CH:5]([C:6](=[O:7])[OH:8])[CH2:9][CH2:10][CH2:11]1)[CH2:12][CH:13]([CH3:14])[CH3:15].[c:16]1([CH2:22][CH2:23][CH2:24][CH2:25][NH-:26])[cH:17][cH:18][cH:19][cH:20][cH:21]1>>[NH:1]([CH:2]([CH2:3][N:4]1[CH:5]([C:6](=[O:7])[OH:8])[CH2:9][CH2:10][CH2:11]1)[CH2:12][CH:13]([CH3:14])[CH3:15])[C:44]([C:34]12[CH2:35][CH:36]3[CH2:37][CH:38]([CH2:39][CH:40]([CH2:41]1)[CH2:42]3)[CH2:43]2)=[O:45].[c:16]1([CH2:22][CH2:23][CH2:24][CH2:25][NH-:26])[cH:17][cH:18][cH:19][cH:20][cH:21]1Participants
7
Sources & evidence
- ORD record
- ord-d1f256e648454d2fb602b6e03c55cff1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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