Sodium ion → HCID 69914932, compound

HRID 157500Notes

Reaction equation

HRID 157500 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15]([C:41]([F:42])([F:43])[F:44])[c:16]([CH2:20][C:21](=[O:22])[c:23]3[cH:24][c:25]([C:29]#[C:30][c:31]4[cH:32][n:33][cH:34][c:35]([C:37](=[O:38])[O:39][CH3:40])[cH:36]4)[cH:26][cH:27][cH:28]3)[cH:17][cH:18][cH:19]2)[CH2:12][CH2:13]1.[CH:47]([OH:48])([CH3:49])[CH3:50].[Na+:46].[OH-:45]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15]([C:41]([F:42])([F:43])[F:44])[c:16]([CH2:20][C:21](=[O:22])[c:23]3[cH:24][c:25]([C:29]#[C:30][c:31]4[cH:32][n:33][cH:34][c:35]([C:37](=[O:38])[OH:39])[cH:36]4)[cH:26][cH:27][cH:28]3)[cH:17][cH:18][cH:19]2)[CH2:12][CH2:13]1

Participants

5

Reactant 4

HCID 923Sodium ionHCID 961HydroxideHCID 3776IsopropanolHCID 69914948HCID 69914948, compound

Product 1

HCID 69914932HCID 69914932, compound

Sources & evidence

ORD record
ord-a853e2a173bf47bbb6da749847ca2649
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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