Sodium ion → HCID 178491592, compound

HRID 1131415Notes

Reaction equation

HRID 1131415 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([C:9]([c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)([c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[NH:22][CH2:23][CH2:24][N:25]([CH2:26][C:27](=[O:28])[O:29][CH3:30])[C:31]([CH2:32][c:33]2[n:34][nH:35][c:36]3[n:37][cH:38][n:39][c:40]([NH:42][C:43](=[O:44])[c:45]4[cH:46][cH:47][c:48]([O:51][CH3:52])[cH:49][cH:50]4)[c:41]23)=[O:53])[cH:7][cH:8]1.[Na+:55].[O:56]1[CH2:57][CH2:58][O:59][CH2:60][CH2:61]1.[OH-:54]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([C:9]([c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)([c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[NH:22][CH2:23][CH2:24][N:25]([CH2:26][C:27](=[O:28])[OH:29])[C:31]([CH2:32][c:33]2[n:34][nH:35][c:36]3[n:37][cH:38][n:39][c:40]([NH:42][C:43](=[O:44])[c:45]4[cH:46][cH:47][c:48]([O:51][CH3:52])[cH:49][cH:50]4)[c:41]23)=[O:53])[cH:7][cH:8]1

Participants

5

Reactant 4

HCID 923Sodium ionHCID 961HydroxideHCID 312751,4-DioxaneHCID 178501607HCID 178501607, compound

Product 1

HCID 178491592HCID 178491592, compound

Sources & evidence

ORD record
ord-5a6e3b1a2aed442fb1d43fff74c6f716
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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