Water → HCID 59508073, compound
Reaction equation
[Br:1][c:2]1[c:3](-[c:30]2[c:31]([O:36][CH3:37])[n:32][cH:33][cH:34][cH:35]2)[n:4]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[c:5]2[cH:6][cH:7][c:8]([C:11]([NH:12][CH2:13][CH2:14][CH2:15][N:16]3[CH2:17][CH2:18][O:19][CH2:20][CH2:21]3)=[O:22])[cH:9][c:10]12.[C:47](=[O:48])([O-:49])[O-:50].[Cs+:51].[Cs+:52].[O:53]1[CH2:54][CH2:55][O:56][CH2:57][CH2:58]1.[OH2:59].[OH:38][B:39]([OH:40])[c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[cH:60]1[cH:61][cH:62][c:63]([P:64]([Pd:65]([P:66]([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)([c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)([P:85]([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)([c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)[P:104]([c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)([c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)[c:117]2[cH:118][cH:119][cH:120][cH:121][cH:122]2)([c:123]2[cH:124][cH:125][cH:126][cH:127][cH:128]2)[c:129]2[cH:130][cH:131][cH:132][cH:133][cH:134]2)[cH:135][cH:136]1>>[c:2]1(-[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[c:3](-[c:30]2[c:31]([O:36][CH3:37])[n:32][cH:33][cH:34][cH:35]2)[n:4]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[c:5]2[cH:6][cH:7][c:8]([C:11]([NH:12][CH2:13][CH2:14][CH2:15][N:16]3[CH2:17][CH2:18][O:19][CH2:20][CH2:21]3)=[O:22])[cH:9][c:10]12Participants
8
Sources & evidence
- ORD record
- ord-805542620edf49ad9c7a56628836de65
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…