Water → tert-butyl N-[1-[2-(1,3-dioxolan-2-yl)-4-methoxyanilino]-3-hydroxy-2-methyl-1-oxopropan-2-yl]carbamate

HRID 310353Notes

Reaction equation

HRID 310353 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]([C:10](=[O:11])[OH:12])([CH2:13][OH:14])[CH3:15].[CH3:46][N+:47]([CH3:48])=[C:49]([N:50]([CH3:51])[CH3:52])[O:53][n:54]1[c:55]2[n:56][cH:57][cH:58][cH:59][c:60]2[n:61][n:62]1.[CH3:69][CH2:70][O:71][C:72](=[O:73])[CH3:74].[CH:16]([N:17]([CH2:18][CH3:19])[CH:20]([CH3:21])[CH3:22])([CH3:23])[CH3:24].[O:25]1[CH:26]([c:30]2[c:31]([NH2:32])[cH:33][cH:34][c:35]([O:37][CH3:38])[cH:36]2)[O:27][CH2:28][CH2:29]1.[O:63]=[CH:64][N:65]([CH3:66])[CH3:67].[OH2:68].[P-:39]([F:40])([F:41])([F:42])([F:43])([F:44])[F:45]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]([C:10](=[O:12])[NH:32][c:31]1[c:30]([CH:26]2[O:25][CH2:29][CH2:28][O:27]2)[cH:36][c:35]([O:37][CH3:38])[cH:34][cH:33]1)([CH2:13][OH:14])[CH3:15]

Participants

9

Reactant 8

HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 132218752-{[(Tert-butoxy)carbonyl]amino}-3-hydroxy-2-methylpropanoic acidHCID 153389082-(1,3-Dioxolan-2-yl)-4-methoxyaniline

Product 1

HCID 77944336tert-butyl N-[1-[2-(1,3-dioxolan-2-yl)-4-methoxyanilino]-3-hydroxy-2-methyl-1-oxopropan-2-yl]carbamate

Sources & evidence

ORD record
ord-29a6f58be7f04b1a8a7a22c9ce79670e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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