Acetate → 4-[7-(2-Methoxyphenyl)-1-(ethoxycarbonylmethyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]piperazine-1-carboxylic acid tert-butyl ester
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[n:15][c:16]3[n:17]([CH3:31])[c:18](=[O:30])[n:19]([CH2:24][C:25](=[O:26])[O:27][CH2:28][CH3:29])[c:20](=[O:23])[c:21]3[nH:22]2)[CH2:12][CH2:13]1.[C:54]([O-:55])(=[O:56])[CH3:57].[C:59]([O-:60])(=[O:61])[CH3:62].[CH3:32][O:33][c:34]1[c:35]([B:40]([OH:41])[OH:42])[cH:36][cH:37][cH:38][cH:39]1.[Cu+2:58].[O:49]1[CH2:50][CH2:51][CH2:52][CH2:53]1.[cH:43]1[cH:44][cH:45][n:46][cH:47][cH:48]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[n:15][c:16]3[n:17]([CH3:31])[c:18](=[O:30])[n:19]([CH2:24][C:25](=[O:26])[O:27][CH2:28][CH3:29])[c:20](=[O:23])[c:21]3[n:22]2-[c:35]2[c:34]([O:33][CH3:32])[cH:39][cH:38][cH:37][cH:36]2)[CH2:12][CH2:13]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-94580ee0cd8a4aba92ee462a73a0ab7e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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