N,N-Dimethylaniline → HCID 178445509, compound

HRID 136637Notes

Reaction equation

HRID 136637 reaction equation
[CH2:1]([CH3:2])[CH:3]1[CH:4]([O:22][C:23]([CH2:24][OH:25])=[O:26])[C:5]2([CH3:6])[CH:7]([CH2:8]1)[CH:9]1[CH2:10][CH2:11][C:12]3=[CH:13][C:14](=[O:21])[CH2:15][CH2:16][CH:17]3[CH:18]1[CH2:19][CH2:20]2.[CH3:27][N:28]([c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)[CH3:35].[CH3:36][CH:37]([C:38](=[O:39])[Cl:40])[CH2:41][CH2:42][CH3:43].[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[Cl:44][CH2:45][Cl:46]>>[CH2:1]([CH3:2])[CH:3]1[CH:4]([O:22][C:23]([CH2:24][O:25][C:38]([CH:37]([CH3:36])[CH2:41][CH2:42][CH3:43])=[O:39])=[O:26])[C:5]2([CH3:6])[CH:7]([CH2:8]1)[CH:9]1[CH2:10][CH2:11][C:12]3=[CH:13][C:14](=[O:21])[CH2:15][CH2:16][CH:17]3[CH:18]1[CH2:19][CH2:20]2

Participants

6

Reactant 5

HCID 949N,N-DimethylanilineHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 1073852-Methylvaleryl chlorideHCID 178435318(16-ethyl-13-methyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl) 2-hydroxyacetate

Product 1

HCID 178445509HCID 178445509, compound

Sources & evidence

ORD record
ord-16fa312c2deb47d89384fdeea07d6676
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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