Methane → 1-O-benzyl 3-O-tert-butyl 4-hydroxy-3-methylpyrrolidine-1,3-dicarboxylate

HRID 159707Notes

Reaction equation

HRID 159707 reaction equation
[C:43].[CH2:29]([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[O:36][C:37](=[O:38])[Cl:39].[CH3:40][CH2:41][OH:42].[ClH:23].[H:45][H:46].[Na+:24].[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1.[OH2:47].[OH:1][CH:2]1[C:3]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])([CH3:22])[CH2:4][N:5]([CH:7]([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[CH3:14])[CH2:6]1.[OH:25][C:26](=[O:27])[O-:28].[Pd:44]>>[OH:1][CH:2]1[C:3]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])([CH3:22])[CH2:4][N:5]([C:37]([O:36][CH2:29][c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)=[O:38])[CH2:6]1

Participants

12

Reactant 11

HCID 297MethaneHCID 313Hydrochloric AcidHCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 8028TetrahydrofuranHCID 10387Benzyl chloroformateHCID 23938PalladiumHCID 178418361HCID 178418361, compoundHCID 178436069HCID 178436069, compound

Product 1

HCID 775723481-O-benzyl 3-O-tert-butyl 4-hydroxy-3-methylpyrrolidine-1,3-dicarboxylate

Sources & evidence

ORD record
ord-20a42e0ada9145ecbb010d437e983d76
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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