Pyrrolidone carboxylic acid → Methyl 2-hydroxy-6-[4-[[2-[(5-oxopyrrolidine-2-carbonyl)amino]-3-[4-(1,1,3-trioxo-1,2-thiazolidin-5-yl)phenyl]propanoyl]amino]butoxy]benzoate

HRID 157556Notizen

Reaktionsgleichung

Reaktionsgleichung von HRID 157556
[CH3:17][N+:18]([CH3:19])=[C:20]([N:21]([CH3:22])[CH3:23])[O:24][n:25]1[c:26]2[n:27][cH:28][cH:29][cH:30][c:31]2[n:32][n:33]1.[CH:34]([N:35]([CH2:36][CH3:37])[CH:38]([CH3:39])[CH3:40])([CH3:41])[CH3:42].[NH2:43][CH:44]([C:45](=[O:46])[NH:47][CH2:48][CH2:49][CH2:50][CH2:51][O:52][c:53]1[c:54]([C:55](=[O:56])[O:57][CH3:58])[c:59]([OH:63])[cH:60][cH:61][cH:62]1)[CH2:64][c:65]1[cH:66][cH:67][c:68]([CH:71]2[CH2:72][C:73](=[O:78])[NH:74][S:75]2(=[O:76])=[O:77])[cH:69][cH:70]1.[O:1]=[C:2]1[CH2:3][CH2:4][CH:5]([C:7](=[O:8])[OH:9])[NH:6]1.[O:79]=[CH:80][N:81]([CH3:82])[CH3:83].[P-:10]([F:11])([F:12])([F:13])([F:14])([F:15])[F:16]>>[O:1]=[C:2]1[CH2:3][CH2:4][CH:5]([C:7](=[O:9])[NH:43][CH:44]([C:45](=[O:46])[NH:47][CH2:48][CH2:49][CH2:50][CH2:51][O:52][c:53]2[c:54]([C:55](=[O:56])[O:57][CH3:58])[c:59]([OH:63])[cH:60][cH:61][cH:62]2)[CH2:64][c:65]2[cH:66][cH:67][c:68]([CH:71]3[CH2:72][C:73](=[O:78])[NH:74][S:75]3(=[O:76])=[O:77])[cH:69][cH:70]2)[NH:6]1

Komponenten

7

Edukt 6

HCID 499Pyrrolidone carboxylic acidHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 178498959methyl 2-[4-[[2-amino-3-[4-(1,1,3-trioxo-1,2-thiazolidin-5-yl)phenyl]propanoyl]amino]butoxy]-6-hydroxybenzoate

Produkt 1

HCID 21879426Methyl 2-hydroxy-6-[4-[[2-[(5-oxopyrrolidine-2-carbonyl)amino]-3-[4-(1,1,3-trioxo-1,2-thiazolidin-5-yl)phenyl]propanoyl]amino]butoxy]benzoate

Quellen und Nachweise

ORD-Eintrag
ord-85b42e5bfbb04697a1c23458cdcdeb12
Quelldatensatz
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

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