Sodium Ion → 2-[3-(2-tert-butoxycarbonylaminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-2-methylpropionic acid
Reaktionsgleichung
[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH3:6])([CH3:7])[c:8]1[cH:9][c:10]2[c:11]([CH2:25][CH2:26][NH:27][C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[c:12](-[c:17]3[cH:18][c:19]([CH3:24])[cH:20][c:21]([CH3:23])[cH:22]3)[nH:13][c:14]2[cH:15][cH:16]1)=[O:35].[Na+:37].[OH-:36]>>[O:3]=[C:4]([C:5]([CH3:6])([CH3:7])[c:8]1[cH:9][c:10]2[c:11]([CH2:25][CH2:26][NH:27][C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[c:12](-[c:17]3[cH:18][c:19]([CH3:24])[cH:20][c:21]([CH3:23])[cH:22]3)[nH:13][c:14]2[cH:15][cH:16]1)[OH:35]Komponenten
4
Quellen und Nachweise
- ORD-Eintrag
- ord-bb65dc2d72d94c5690fabc3c1cf6f1a7
- Quelldatensatz
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)