Water → HCID 178514799, compound
Reaction equation
[F:38][C:39]([F:40])([F:41])[C:42]([OH:43])=[O:44].[OH2:45].[S:1]([NH2:2])([O:3][CH2:4][CH:5]1[O:6][CH:7]([n:15]2[c:16]3[n:17][cH:18][n:19][c:20]([C:24]#[C:25][c:26]4[c:27]([C:32]([F:33])([F:34])[F:35])[cH:28][cH:29][cH:30][cH:31]4)[c:21]3[n:22][cH:23]2)[CH:8]2[O:9][C:10]([CH3:13])([CH3:14])[O:11][CH:12]12)(=[O:36])=[O:37]>>[S:1]([NH2:2])([O:3][CH2:4][CH:5]1[O:6][CH:7]([n:15]2[c:16]3[n:17][cH:18][n:19][c:20]([C:24]#[C:25][c:26]4[c:27]([C:32]([F:33])([F:34])[F:35])[cH:28][cH:29][cH:30][cH:31]4)[c:21]3[n:22][cH:23]2)[CH:8]([OH:9])[CH:12]1[OH:11])(=[O:36])=[O:37]Participants
4
Sources & evidence
- ORD record
- ord-4a5d147135aa4645adb1e31f6f13a714
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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