Sodium ion → HCID 10053729, compound

HRID 693735Notes

Reaction equation

HRID 693735 reaction equation
[CH2:45]([C:46]([O:47][c:48]1[cH:49][cH:50][c:51]([CH:52]([CH3:53])[CH3:54])[cH:55][cH:56]1)([CH2:57][c:58]1[cH:59][cH:60][c:61]([O:62][CH2:63][CH2:64][NH:65][C:66](=[O:67])[c:68]2[cH:69][cH:70][c:71](-[c:72]3[n:73][cH:74][c:75]([N+:76]([O-:77])=[O:78])[cH:79][cH:80]3)[cH:81][cH:82]2)[cH:83][cH:84]1)[C:85]([OH:86])=[O:87])[CH3:88].[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([O:8][CH:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[CH2:15][c:16]2[cH:17][cH:18][c:19]([O:22][CH2:23][CH2:24][NH:25][C:26]([c:27]3[cH:28][cH:29][c:30](-[c:33]4[cH:34][cH:35][c:36]([N+:39](=[O:40])[O-:41])[cH:37][n:38]4)[cH:31][cH:32]3)=[O:42])[cH:20][cH:21]2)[cH:43][cH:44]1.[Na+:90].[OH-:89]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([O:8][CH:9]([C:10](=[O:11])[OH:12])[CH2:15][c:16]2[cH:17][cH:18][c:19]([O:22][CH2:23][CH2:24][NH:25][C:26]([c:27]3[cH:28][cH:29][c:30](-[c:33]4[cH:34][cH:35][c:36]([N+:39](=[O:40])[O-:41])[cH:37][n:38]4)[cH:31][cH:32]3)=[O:42])[cH:20][cH:21]2)[cH:43][cH:44]1

Participants

5

Reactant 4

HCID 923Sodium ionHCID 961HydroxideHCID 18625850HCID 18625850, compoundHCID 18625969HCID 18625969, compound

Product 1

HCID 10053729HCID 10053729, compound

Sources & evidence

ORD record
ord-57b52ded9e9d49a6860df9c942b410c6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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