Hydrochloric Acid → 3-{4-[1-Allyl-1-(2,6-dimethyl-4'-trifluoromethyl-biphenyl-4-yloxymethyl)-but-3-enyl]-benzoylamino}-propionic acid

HRID 285669

Reaktionsgleichung

Reaktionsgleichung von HRID 285669
[CH2:46]1[O:47][CH2:48][CH2:49][CH2:50]1.[CH3:1][O:2][C:3]([CH2:4][CH2:5][NH:6][C:7]([c:8]1[cH:9][cH:10][c:11]([C:14]([CH2:15][CH:16]=[CH2:17])([CH2:18][O:19][c:20]2[cH:21][c:22]([CH3:37])[c:23](-[c:27]3[cH:28][cH:29][c:30]([C:33]([F:34])([F:35])[F:36])[cH:31][cH:32]3)[c:24]([CH3:26])[cH:25]2)[CH2:38][CH:39]=[CH2:40])[cH:12][cH:13]1)=[O:41])=[O:42].[ClH:45].[Li+:44].[OH-:43].[OH2:51]>>[O:2]=[C:3]([CH2:4][CH2:5][NH:6][C:7]([c:8]1[cH:9][cH:10][c:11]([C:14]([CH2:15][CH:16]=[CH2:17])([CH2:18][O:19][c:20]2[cH:21][c:22]([CH3:37])[c:23](-[c:27]3[cH:28][cH:29][c:30]([C:33]([F:34])([F:35])[F:36])[cH:31][cH:32]3)[c:24]([CH3:26])[cH:25]2)[CH2:38][CH:39]=[CH2:40])[cH:12][cH:13]1)=[O:41])[OH:42]

Komponenten

7

Edukt 6

HCID 313Hydrochloric AcidHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 674863613-{4-[1-Allyl-1-(2,6-dimethyl-4'-trifluoromethyl-biphenyl-4-yloxymethyl)-but-3-enyl]-benzoylamino}-propionic acid methyl ester

Produkt 1

HCID 167504293-{4-[1-Allyl-1-(2,6-dimethyl-4'-trifluoromethyl-biphenyl-4-yloxymethyl)-but-3-enyl]-benzoylamino}-propionic acid

Quellen und Nachweise

ORD-Eintrag
ord-59fd3d1642d347d09b78fcb704fb1ed3
Quelldatensatz
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

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