Water → HCID 21088982, compound
Reaction equation
[CH3:30][N:31]1[CH2:32][CH2:33][O:34][CH2:35][CH2:36]1.[CH3:57][N:58]([c:59]1[cH:60][cH:61][n:62][cH:63][cH:64]1)[CH3:65].[CH3:66][C:67]#[N:68].[Cl:37][C:38]([O:39][CH2:40][CH:41]([CH3:42])[CH3:43])=[O:44].[F:1][c:2]1[c:3]([CH2:4][O:5][c:6]2[n:7][cH:8][n:9](-[c:15]3[cH:16][c:17]([C:18](=[O:19])[OH:20])[cH:21][cH:22][c:23]3[CH3:24])[c:10](=[O:14])[c:11]2[CH2:12][CH3:13])[cH:25][cH:26][c:27]([F:29])[cH:28]1.[F:50][C:51]([F:52])([F:53])[C:54]([OH:55])=[O:56].[NH2:45][CH:46]([CH2:47][OH:48])[CH3:49].[OH2:69]>>[F:1][c:2]1[c:3]([CH2:4][O:5][c:6]2[n:7][cH:8][n:9](-[c:15]3[cH:16][c:17]([C:18](=[O:20])[NH:45][CH:46]([CH2:47][OH:48])[CH3:49])[cH:21][cH:22][c:23]3[CH3:24])[c:10](=[O:14])[c:11]2[CH2:12][CH3:13])[cH:25][cH:26][c:27]([F:29])[cH:28]1Participants
9
Sources & evidence
- ORD record
- ord-ae7a28eb93f04d36a4b185d2b151aec6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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