Methanol → 3-[3-(1-tert-butylcarbonylmethyl-2-oxo-5-cyclohexyl-8-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-3-yl)ureido]benzoic acid
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[C:5](=[O:6])[CH2:7][N:8]1[C:9](=[O:41])[CH:10]([NH:26][C:27](=[O:28])[NH:29][c:30]2[cH:31][c:32]([C:36](=[O:37])[O:38][CH2:39][CH3:40])[cH:33][cH:34][cH:35]2)[CH2:11][N:12]([CH:20]2[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]2)[c:13]2[c:14]1[cH:15][c:16]([CH3:19])[cH:17][cH:18]2.[CH3:45][OH:46].[Li+:44].[OH-:43].[OH2:42]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[C:5](=[O:6])[CH2:7][N:8]1[C:9](=[O:41])[CH:10]([NH:26][C:27](=[O:28])[NH:29][c:30]2[cH:31][c:32]([C:36](=[O:37])[OH:38])[cH:33][cH:34][cH:35]2)[CH2:11][N:12]([CH:20]2[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]2)[c:13]2[c:14]1[cH:15][c:16]([CH3:19])[cH:17][cH:18]2Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-f59a7a2f44114325806c782d1b8fcb19
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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