HCID 22336948, compound → HCID 178490281, compound
Reaction equation
[C:1]([O:2][C:6]([NH:7][CH:8]([CH3:9])[C:10]([NH:11][CH:12]([CH2:13][CH:14]([CH3:15])[CH3:16])[B:17]1[O:18][C:19]2([CH3:29])[CH:20]3[C:21]([CH3:27])([CH3:28])[CH:22]([CH2:23][CH:24]2[O:25]1)[CH2:26]3)=[O:30])=[O:31])([CH3:3])([CH3:4])[CH3:5].[c:32]1(-[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[cH:33][c:34]([NH:38][CH:39]([C:40]([OH:41])=[O:42])[CH2:43][c:44]2[cH:45][cH:46][c:47]([O:50][CH3:51])[cH:48][cH:49]2)[cH:35][cH:36][cH:37]1>>[C:6]([NH:7][CH:8]([CH3:9])[C:10]([NH:11][CH:12]([CH2:13][CH:14]([CH3:15])[CH3:16])[B:17]1[O:18][C:19]2([CH3:29])[CH:20]3[C:21]([CH3:27])([CH3:28])[CH:22]([CH2:23][CH:24]2[O:25]1)[CH2:26]3)=[O:30])(=[O:31])[CH:39]([NH:38][c:34]1[cH:33][c:32](-[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[cH:37][cH:36][cH:35]1)[CH2:43][c:44]1[cH:45][cH:46][c:47]([O:50][CH3:51])[cH:48][cH:49]1Participants
3
Sources & evidence
- ORD record
- ord-a8e65f76a84a4aa5ba358833c37b0ac8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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