HCID 72280399, compound → HCID 178458693, compound
Reaction equation
[CH2:19]([CH:20]=[CH2:21])[O:22][CH:23]1[CH2:24][CH:25]([NH:34][CH2:35][CH:36]([CH:37]([CH2:38][c:39]2[cH:40][c:41]([Cl:46])[cH:42][c:43]([Cl:45])[cH:44]2)[NH2:47])[OH:48])[c:26]2[cH:27][c:28]([O:32][CH3:33])[cH:29][cH:30][c:31]21.[F:1][C:2]([CH2:3][CH2:4][S:5](=[O:6])(=[O:7])[N:8]([CH3:9])[CH:10]([C:11](=[O:12])[OH:13])[CH2:14][CH:15]=[CH2:16])([F:17])[F:18]>>[F:1][C:2]([CH2:3][CH2:4][S:5](=[O:6])(=[O:7])[N:8]([CH3:9])[CH:10]([C:11](=[O:13])[NH:47][CH:37]([CH:36]([CH2:35][NH:34][CH:25]1[CH2:24][CH:23]([O:22][CH2:19][CH:20]=[CH2:21])[c:31]2[c:26]1[cH:27][c:28]([O:32][CH3:33])[cH:29][cH:30]2)[OH:48])[CH2:38][c:39]1[cH:40][c:41]([Cl:46])[cH:42][c:43]([Cl:45])[cH:44]1)[CH2:14][CH:15]=[CH2:16])([F:17])[F:18]Participants
3
Sources & evidence
- ORD record
- ord-ecff6a8a414f406dba5be2815e2348e1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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