Acetate → 6-Methoxy-10-(4-methoxy-phenyl)-5-nitro-2,3,4,4a,10,10a-hexahydro-1H-phenanthren-9-one

HRID 1565195Notes

Reaction equation

HRID 1565195 reaction equation
[Br:21][c:22]1[cH:23][cH:24][c:25]([O:28][CH3:29])[cH:26][cH:27]1.[C:30]([PH2:31])([CH3:32])([CH3:33])[CH3:34].[C:41]([O-:42])(=[O:43])[CH3:44].[C:46]([O-:47])(=[O:48])[CH3:49].[CH3:1][O:2][c:3]1[c:4]([N+:18](=[O:19])[O-:20])[c:5]2[c:14]([cH:15][cH:16]1)[C:13](=[O:17])[CH2:12][CH:11]1[CH:6]2[CH2:7][CH2:8][CH2:9][CH2:10]1.[CH3:35][C:36]([CH3:37])([O-:38])[CH3:39].[Na+:40].[O:50]1[CH2:51][CH2:52][CH2:53][CH2:54]1.[Pd+2:45]>>[CH3:1][O:2][c:3]1[c:4]([N+:18](=[O:19])[O-:20])[c:5]2[c:14]([cH:15][cH:16]1)[C:13](=[O:17])[CH:12]([c:22]1[cH:23][cH:24][c:25]([O:28][CH3:29])[cH:26][cH:27]1)[CH:11]1[CH:6]2[CH2:7][CH2:8][CH2:9][CH2:10]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 923Sodium ionHCID 77304-BromoanisoleHCID 8028TetrahydrofuranHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 123165tert-ButylphosphineHCID 45749132-Methylpropan-2-olateHCID 666522766-Methoxy-5-nitro-2,3,4,4a,10,10a-hexahydro-1H-phenanthren-9-one

Product 1

HCID 666520666-Methoxy-10-(4-methoxy-phenyl)-5-nitro-2,3,4,4a,10,10a-hexahydro-1H-phenanthren-9-one

Sources & evidence

ORD record
ord-1e8361b45461466b9adc6eeebe04765d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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