Dichloromethane → HCID 178450940, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH2:8][CH:9]([NH:10][C:11]([CH2:12][CH:13]([CH:14]=[CH:15][CH2:16][CH2:17][S:18][C:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)([c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)[OH:38])=[O:39])[C:40]([NH:41][CH:42]([CH2:43][S:44][C:45]([c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1)([c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1)[c:58]1[cH:59][cH:60][cH:61][cH:62][cH:63]1)[C:64]([NH:65][C:66]1([CH:69]([CH2:70][C:71](=[O:72])[OH:73])[OH:74])[CH2:67][CH2:68]1)=[O:75])=[O:76])=[O:77].[CH3:78][N:79]([c:80]1[cH:81][cH:82][n:83][cH:84][cH:85]1)[CH3:86].[Cl:87][CH2:88][Cl:89]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH2:8][CH:9]1[NH:10][C:11](=[O:39])[CH2:12][CH:13]([CH:14]=[CH:15][CH2:16][CH2:17][S:18][C:19]([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)([c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[O:38][C:71](=[O:72])[CH2:70][CH:69]([OH:74])[C:66]2([NH:65][C:64](=[O:75])[CH:42]([CH2:43][S:44][C:45]([c:46]3[cH:47][cH:48][cH:49][cH:50][cH:51]3)([c:52]3[cH:53][cH:54][cH:55][cH:56][cH:57]3)[c:58]3[cH:59][cH:60][cH:61][cH:62][cH:63]3)[NH:41][C:40]1=[O:76])[CH2:67][CH2:68]2)=[O:77]Participants
4
Sources & evidence
- ORD record
- ord-c51fcbca9db84a6381cbdfcbc227085b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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