Trifluoroacetic acid → Methyl 2-[2-[[2-[[3-benzyloxy-2-(tert-butoxycarbonylamino)propanoyl]amino]-3-(4-benzyloxyphenyl)propanoyl]amino]propanoylamino]-4-methyl-pentanoate
Reaction equation
[C:76]([CH3:77])([CH3:78])([CH3:79])[O:80][C:81](=[O:82])[NH:83][CH:84]([CH2:85][O:86][CH2:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1)[C:94](=[O:95])[OH:96].[CH3:112][CH2:113][N:114]([CH2:115][CH3:116])[CH2:117][CH3:118].[CH3:1][O:2][C:3]([CH:4]([NH:5][C:6]([CH:7]([NH:8][C:9]([CH:10]([NH2:11])[CH2:12][c:13]1[cH:14][cH:15][c:16]([O:19][CH2:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:17][cH:18]1)=[O:27])[CH3:28])=[O:29])[CH2:30][CH:31]([CH3:32])[CH3:33])=[O:34].[CH3:42][O:43][C:44](=[O:45])[CH:46]([CH2:47][CH:48]([CH3:49])[CH3:50])[NH:51][C:52](=[O:53])[CH:54]([CH3:55])[NH:56][C:57](=[O:58])[CH:59]([CH2:60][c:61]1[cH:62][cH:63][c:64]([O:65][CH2:66][c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[cH:73][cH:74]1)[NH2:75].[CH:97]1([N:98]=[C:99]=[N:100][CH:101]2[CH2:102][CH2:103][CH2:104][CH2:105][CH2:106]2)[CH2:107][CH2:108][CH2:109][CH2:110][CH2:111]1.[F:35][C:36]([F:37])([F:38])[C:39]([OH:40])=[O:41]>>[CH3:1][O:2][C:3]([CH:4]([NH:5][C:6]([CH:7]([NH:8][C:9]([CH:10]([NH:11][C:94]([CH:84]([NH:83][C:81]([O:80][C:76]([CH3:77])([CH3:78])[CH3:79])=[O:82])[CH2:85][O:86][CH2:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1)=[O:95])[CH2:12][c:13]1[cH:14][cH:15][c:16]([O:19][CH2:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:17][cH:18]1)=[O:27])[CH3:28])=[O:29])[CH2:30][CH:31]([CH3:32])[CH3:33])=[O:34]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-dc323f8cbb1249949a0ce643feb878cf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…