Acetic Acid → Lansoprazole

HRID 1201993Notes

Reaction equation

HRID 1201993 reaction equation
[CH3:1][c:2]1[c:3]([CH2:14][S:15][c:16]2[n:17][c:18]3[c:19]([nH:20]2)[cH:21][cH:22][cH:23][cH:24]3)[n:4][cH:5][cH:6][c:7]1[O:8][CH2:9][C:10]([F:11])([F:12])[F:13].[CH3:32][C:33](=[O:34])[OH:35].[CH3:36][CH2:37][OH:38].[Na+:25].[Na+:26].[O-:27][S:28]([O-:29])(=[S:30])=[O:31].[OH2:41].[OH:39][OH:40]>>[CH3:1][c:2]1[c:3]([CH2:14][S:15]([c:16]2[nH:17][c:18]3[c:19]([n:20]2)[cH:21][cH:22][cH:23][cH:24]3)=[O:27])[n:4][cH:5][cH:6][c:7]1[O:8][CH2:9][C:10]([F:11])([F:12])[F:13]

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 702EthanolHCID 784Hydrogen PeroxideHCID 923Sodium ion2×HCID 962WaterHCID 1084Thiosulfate ionHCID 1094080Lansoprazole sulfide

Product 1

HCID 3883Lansoprazole

Sources & evidence

ORD record
ord-b40f186585784153847c3fe0cf397caf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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