Hydroxide → HCID 66942199, compound
Reaction equation
[Li+:58].[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:53][cH:54][cH:55][cH:56]2)[CH2:6][CH2:7][N:8]1[CH:9]1[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH:18]([C:19](=[O:20])[N:21]2[CH2:22][CH2:23][C:24]([CH3:27])([N:28]3[CH2:29][CH2:30][N:31]([CH2:34][C:35](=[O:36])[O:37][CH2:38][CH3:39])[CH2:32][CH2:33]3)[CH2:25][CH2:26]2)[CH2:40][c:41]2[cH:42][c:43]([Cl:52])[c:44]([NH2:51])[c:45]([C:47]([F:48])([F:49])[F:50])[cH:46]2)[CH2:13][CH2:14]1.[OH-:57]>>[O:1]=[C:2]1[NH:3][c:4]2[c:5]([cH:53][cH:54][cH:55][cH:56]2)[CH2:6][CH2:7][N:8]1[CH:9]1[CH2:10][CH2:11][N:12]([C:15](=[O:16])[O:17][CH:18]([C:19](=[O:20])[N:21]2[CH2:22][CH2:23][C:24]([CH3:27])([N:28]3[CH2:29][CH2:30][N:31]([CH2:34][C:35](=[O:36])[OH:37])[CH2:32][CH2:33]3)[CH2:25][CH2:26]2)[CH2:40][c:41]2[cH:42][c:43]([Cl:52])[c:44]([NH2:51])[c:45]([C:47]([F:48])([F:49])[F:50])[cH:46]2)[CH2:13][CH2:14]1Participants
4
Sources & evidence
- ORD record
- ord-9db7eac57a90451f9426fe357e24f6a3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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