Trifluoroacetic acid → Trifluoroacetic acid
Reaction equation
[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7].[F:52][C:53]([F:54])([F:55])[C:56]([OH:57])=[O:58].[NH2:8][CH:9]1[CH2:10][N:11]([c:14]2[n:15][c:16]([NH:37][CH2:38][CH:39]([c:40]3[cH:41][cH:42][cH:43][cH:44][cH:45]3)[c:46]3[cH:47][cH:48][cH:49][cH:50][cH:51]3)[c:17]3[n:18][cH:19][n:20]([CH:23]4[CH:24]([OH:36])[CH:25]([OH:35])[CH:26]([n:28]5[n:29][cH:30][c:31]([CH2:33][OH:34])[cH:32]5)[CH2:27]4)[c:21]3[n:22]2)[CH2:12][CH2:13]1.[OH:59][CH:60]1[CH:61]([OH:62])[CH:63]([n:64]2[cH:65][c:66]([CH3:67])[cH:68][n:69]2)[CH2:70][CH:71]1[n:72]1[cH:73][n:74][c:75]2[c:76]1[n:77][c:78]([NH:79][CH:80]1[CH2:81][CH2:82][CH:83]([NH:84][C:104](=[O:105])[NH:106][CH:107]3[CH2:108][CH2:109][N:110]([c:113]4[n:114][cH:115][cH:116][cH:117][cH:118]4)[CH2:111][CH2:112]3)[CH2:85][CH2:86]1)[n:87][c:88]2[NH:89][CH2:90][CH:91]([c:92]1[cH:93][cH:94][cH:95][cH:96][cH:97]1)[c:98]1[cH:99][cH:100][cH:101][cH:102][cH:103]1>>[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7].[NH:8]([CH:9]1[CH2:10][N:11]([c:14]2[n:15][c:16]([NH:37][CH2:38][CH:39]([c:40]3[cH:41][cH:42][cH:43][cH:44][cH:45]3)[c:46]3[cH:47][cH:48][cH:49][cH:50][cH:51]3)[c:17]3[n:18][cH:19][n:20]([CH:23]4[CH:24]([OH:36])[CH:25]([OH:35])[CH:26]([n:28]5[n:29][cH:30][c:31]([CH2:33][OH:34])[cH:32]5)[CH2:27]4)[c:21]3[n:22]2)[CH2:12][CH2:13]1)[C:104](=[O:105])[NH:106][CH:107]1[CH2:108][CH2:109][N:110]([c:113]2[n:114][cH:115][cH:116][cH:117][cH:118]2)[CH2:111][CH2:112]1Participants
5
Reactant 3
Product 2
Sources & evidence
- ORD record
- ord-b0fcc427e66c41ab8dbfc0fba1d603eb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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