Dimethyl Sulfoxide → HCID 44476487, compound

HRID 1124773Notes

Reaction equation

HRID 1124773 reaction equation
[CH3:40][S:41](=[O:42])[CH3:43].[CH3:50][OH:51].[Cl:11][c:12]1[n:13][cH:14][cH:15][c:16]2[c:17](-[c:22]3[n:23][o:24][c:25](-[c:27]4[cH:28][c:29]([Cl:37])[c:30]([O:33][CH:34]([CH3:35])[CH3:36])[cH:31][cH:32]4)[n:26]3)[cH:18][cH:19][cH:20][c:21]12.[H-:9].[Li+:38].[NH:1]1[CH2:2][CH:3]([C:6](=[O:7])[OH:8])[CH2:4][CH2:5]1.[Na+:10].[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1.[OH-:39].[OH2:49]>>[N:1]1([c:12]2[n:13][cH:14][cH:15][c:16]3[c:17](-[c:22]4[n:23][o:24][c:25](-[c:27]5[cH:28][c:29]([Cl:37])[c:30]([O:33][CH:34]([CH3:35])[CH3:36])[cH:31][cH:32]5)[n:26]4)[cH:18][cH:19][cH:20][c:21]23)[CH2:2][CH:3]([C:6](=[O:7])[OH:8])[CH2:4][CH2:5]1

Participants

11

Reactant 10

HCID 679Dimethyl SulfoxideHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 166653HydrideHCID 30346453-Pyrrolidinecarboxylic acidHCID 58149900HCID 58149900, compound

Product 1

HCID 44476487HCID 44476487, compound

Sources & evidence

ORD record
ord-f1e8f789e2484ddbaedf9382da79df74
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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