Methanol → HCID 22176104, compound

HRID 2135156Notes

Reaction equation

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[c:12]([O:28][S:29]([C:30]([F:31])([F:32])[F:33])(=[O:34])=[O:35])[c:13]([C:24](=[O:25])[O:26][CH3:27])[n:14]([CH2:20][CH:21]([CH3:22])[CH3:23])[c:15](=[O:19])[c:16]2[cH:17][cH:18]1.[CH3:135][OH:136].[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[Na+:44].[Na+:45].[O-:46][C:47](=[O:48])[O-:49].[OH2:134].[cH:57]1[cH:58][cH:59][c:60]([P:61]([Pd:62]([P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([P:82]([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[P:101]([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)([c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[c:126]2[cH:127][cH:128][cH:129][cH:130][cH:131]2)[cH:132][cH:133]1.[s:36]1[c:37]([B:41]([OH:42])[OH:43])[cH:38][cH:39][cH:40]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[c:12](-[c:37]3[s:36][cH:40][cH:39][cH:38]3)[c:13]([C:24](=[O:25])[O:26][CH3:27])[n:14]([CH2:20][CH:21]([CH3:22])[CH3:23])[c:15](=[O:19])[c:16]2[cH:17][cH:18]1

Participants

Reactant 8

HCID 19660Carbonate Ion

HCID 27339602-Thiopheneboronic acid

HCID 22175715HCID 22175715, compound

HCID 178420554HCID 178420554, compound

Product 1

HCID 22176104HCID 22176104, compound

Sources & evidence

ORD record: ord-5026547436c542e2b48af257ca612678
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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