Toluene → 3-{3-Fluoro-4-[1-(2-methyl-4'-trifluoromethyl-biphenyl-4-yl)-heptyloxy]-benzoylamino}-propionic acid ethyl ester
Reaktionsgleichung
[CH2:26]([CH3:27])[O:28][C:29]([CH2:30][CH2:31][NH:32][C:33]([c:34]1[cH:35][c:36]([F:41])[c:37]([OH:40])[cH:38][cH:39]1)=[O:42])=[O:43].[CH2:44]([P:45]([CH2:46][CH2:47][CH2:48][CH3:49])[CH2:50][CH2:51][CH2:52][CH3:53])[CH2:54][CH2:55][CH3:56].[CH3:1][c:2]1[c:3](-[c:16]2[cH:17][cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]2)[cH:4][cH:5][c:6]([CH:8]([CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH3:14])[OH:15])[cH:7]1.[CH3:57][CH2:58][O:59][C:60](=[O:61])[CH3:62].[CH3:63][c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1>>[CH3:1][c:2]1[c:3](-[c:16]2[cH:17][cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]2)[cH:4][cH:5][c:6]([CH:8]([CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH3:14])[O:15][c:37]2[c:36]([F:41])[cH:35][c:34]([C:33]([NH:32][CH2:31][CH2:30][C:29]([O:28][CH2:26][CH3:27])=[O:43])=[O:42])[cH:39][cH:38]2)[cH:7]1Komponenten
6
Edukt 5
Produkt 1
Quellen und Nachweise
- ORD-Eintrag
- ord-9583e961fa144d4283a19bdbae3d796d
- Quelldatensatz
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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