Dimethylformamide → oxetan-3-yl 2-(hydroxymethyl)-2-methyl-5-(4-phenylphenyl)-4-(2H-triazole-4-carbonylamino)pentanoate

HRID 167594Notizen

Reaktionsgleichung

[CH:9]([N:10]([CH2:11][CH3:12])[CH:13]([CH3:14])[CH3:15])([CH3:16])[CH3:17].[O:42]1[CH2:43][CH:44]([O:46][C:47]([C:48]([CH2:49][CH:50]([CH2:51][c:52]2[cH:53][cH:54][c:55](-[c:58]3[cH:59][cH:60][cH:61][cH:62][cH:63]3)[cH:56][cH:57]2)[NH2:64])([CH3:65])[CH2:66][OH:67])=[O:68])[CH2:45]1.[O:69]=[CH:70][N:71]([CH3:72])[CH3:73].[P-:18]([F:19])([F:20])([F:21])([F:22])([F:23])[F:24].[n:25]1([O:26][C:27]([N:28]([CH3:29])[CH3:30])=[N+:31]([CH3:32])[CH3:33])[c:34]2[n:35][cH:36][cH:37][cH:38][c:39]2[n:40][n:41]1.[nH:1]1[n:2][n:3][c:4]([C:6](=[O:7])[OH:8])[cH:5]1>>[n:1]1[n:2][nH:3][c:4]([C:6](=[O:8])[NH:64][CH:50]([CH2:49][C:48]([C:47]([O:46][CH:44]2[CH2:43][O:42][CH2:45]2)=[O:68])([CH3:65])[CH2:66][OH:67])[CH2:51][c:52]2[cH:53][cH:54][c:55](-[c:58]3[cH:59][cH:60][cH:61][cH:62][cH:63]3)[cH:56][cH:57]2)[cH:5]1

Komponenten

Edukt 6

HCID 6228Dimethylformamide

HCID 9886Hexafluorophosphate

HCID 81531Diisopropylethylamine

HCID 1401204-Carboxy-1,2,3-triazole

HCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

HCID 77419092HCID 77419092, Verbindung

Produkt 1

HCID 178459055oxetan-3-yl 2-(hydroxymethyl)-2-methyl-5-(4-phenylphenyl)-4-(2H-triazole-4-carbonylamino)pentanoate

Quellen und Nachweise

ORD-Eintrag: ord-1731c760507746ea8e5a9dbd39f8f3a2
Quelldatensatz: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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