Sodium ion → Bromide ion

HRID 672501Notes

Reaction equation

HRID 672501 reaction equation
[C:11]([CH3:12])(=[O:13])[O:14][CH:15]1[C:16]2([CH3:17])[CH:18]([CH2:19][CH:20]1[N:21]1[CH2:22][CH2:23][CH2:24][CH2:25]1)[CH:26]1[CH2:27][CH2:28][CH:29]3[CH2:30][CH:31]([OH:45])[CH:32]([N:39]4[CH2:40][CH2:41][O:42][CH2:43][CH2:44]4)[CH2:33][C:34]3([CH3:35])[CH:36]1[CH2:37][CH2:38]2.[CH2:7]([CH:8]=[CH2:9])[Br:10].[Cl:46][CH2:47][Cl:48].[Na+:1].[Na+:2].[O-:3][C:4](=[O:5])[O-:6]>>[Br-:10].[CH2:7]=[CH:8][CH2:9][N+:21]1([CH:20]2[CH:15]([O:14][C:11]([CH3:12])=[O:13])[C:16]3([CH3:17])[CH:18]([CH2:19]2)[CH:26]2[CH2:27][CH2:28][CH:29]4[CH2:30][CH:31]([OH:45])[CH:32]([N:39]5[CH2:40][CH2:41][O:42][CH2:43][CH2:44]5)[CH2:33][C:34]4([CH3:35])[CH:36]2[CH2:37][CH2:38]3)[CH2:22][CH2:23][CH2:24][CH2:25]1

Participants

7

Reactant 5

HCID 923Sodium ion2×HCID 6344DichloromethaneHCID 7841Allyl bromideHCID 19660Carbonate IonHCID 19870362HCID 19870362, compound

Product 2

HCID 259Bromide ionHCID 446069817-(Acetyloxy)-3-hydroxy-2-(morpholin-4-yl)-16-[1-(prop-2-en-1-yl)pyrrolidin-1-ium-1-yl]androstane

Sources & evidence

ORD record
ord-3fd3e886915a42dabcaf886cbccc51a1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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