Sodium ion → HCID 59340075, compound
Reaction equation
[Br:32][c:33]1[c:34]([CH3:39])[n:35][c:36]([CH3:38])[s:37]1.[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[Na+:40].[Na+:41].[O-:42][C:43](=[O:44])[O-:45].[O:51]1[CH2:52][CH2:53][O:54][CH2:55][CH2:56]1.[OH2:57].[OH:1][c:2]1[c:3]([C:23](=[O:24])[NH:25][CH2:26][C:27](=[O:28])[O:29][CH2:30][CH3:31])[c:4](=[O:22])[n:5]([CH3:21])[c:6]2[cH:7][cH:8][c:9]([B:12]3[O:13][C:14]([CH3:15])([CH3:16])[C:17]([CH3:18])([CH3:19])[O:20]3)[cH:10][c:11]12.[cH:58]1[cH:59][cH:60][c:61]([P:62]([Pd:63]([P:64]([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)([P:83]([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)[c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[P:102]([c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)([c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)[c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)([c:121]2[cH:122][cH:123][cH:124][cH:125][cH:126]2)[c:127]2[cH:128][cH:129][cH:130][cH:131][cH:132]2)[cH:133][cH:134]1>>[OH:1][c:2]1[c:3]([C:23](=[O:24])[NH:25][CH2:26][C:27](=[O:28])[O:29][CH2:30][CH3:31])[c:4](=[O:22])[n:5]([CH3:21])[c:6]2[cH:7][cH:8][c:9](-[c:33]3[c:34]([CH3:39])[n:35][c:36]([CH3:38])[s:37]3)[cH:10][c:11]12Participants
9
Sources & evidence
- ORD record
- ord-cc2c464edc9048beabd8b3818723c8d5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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