Water → HCID 67119111, compound
Reaction equation
[CH2:1]1[NH:2][CH2:3][CH2:4][O:5][CH2:6]1.[CH2:7]([CH:8]=[CH2:9])[O:10][c:11]1[c:12]([C:13](=[O:14])[O:15][C:16]([CH3:17])([CH3:18])[CH3:19])[c:20]([CH2:28][O:29][c:30]2[cH:31][cH:32][c:33](-[c:36]3[cH:37][c:38]([F:53])[c:39]([C:42](=[CH:43][N:44]([CH3:45])[CH3:46])[C:47](=[O:48])[O:49][CH2:50][CH:51]=[CH2:52])[cH:40][cH:41]3)[cH:34][cH:35]2)[cH:21][cH:22][c:23]1[C:24]([F:25])([F:26])[F:27].[O:55]1[CH2:56][CH2:57][CH2:58][CH2:59]1.[OH2:54].[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>>[OH:10][c:11]1[c:12]([C:13](=[O:14])[O:15][C:16]([CH3:17])([CH3:18])[CH3:19])[c:20]([CH2:28][O:29][c:30]2[cH:31][cH:32][c:33](-[c:36]3[cH:37][c:38]([F:53])[c:39]([C:42](=[CH:43][N:44]([CH3:45])[CH3:46])[C:47](=[O:48])[O:49][CH2:50][CH:51]=[CH2:52])[cH:40][cH:41]3)[cH:34][cH:35]2)[cH:21][cH:22][c:23]1[C:24]([F:25])([F:26])[F:27]Participants
6
Sources & evidence
- ORD record
- ord-da938e05dc934af6beb87a80f335631d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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