Dimethylformamide → N-(3-{1-(4-Fluorophenyl)-3-[3-(4-fluorophenyl)-3-hydroxypropyl]-4-oxoazetidin-2-yl}-benzyl)-2-[2-({2-[2-(3,4,5,6,7-pentahydroxy-2-oxoheptyloxy)ethoxy]ethylcarbamoyl}-methoxy)ethoxy]acetamide
Reaction equation
[CH3:82][N:83]([CH3:84])[CH:85]=[O:86].[CH:63]([N:64]=[C:65]=[N:66][CH:67]([CH3:68])[CH3:69])([CH3:70])[CH3:71].[NH2:1][CH2:2][c:3]1[cH:4][c:5]([CH:9]2[CH:10]([CH2:21][CH2:22][CH:23]([OH:24])[c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[C:11](=[O:20])[N:12]2[c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[cH:6][cH:7][cH:8]1.[OH:32][CH:33]([C:34]([CH2:35][O:36][CH2:37][CH2:38][O:39][CH2:40][CH2:41][NH:42][C:43](=[O:44])[CH2:45][O:46][CH2:47][CH2:48][O:49][CH2:50][C:51](=[O:52])[OH:53])=[O:54])[CH:55]([CH:56]([CH:57]([CH2:58][OH:59])[OH:60])[OH:61])[OH:62].[OH:72][c:73]1[c:74]2[n:75][n:76][nH:77][c:78]2[cH:79][cH:80][cH:81]1>>[NH:1]([CH2:2][c:3]1[cH:4][c:5]([CH:9]2[CH:10]([CH2:21][CH2:22][CH:23]([OH:24])[c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[C:11](=[O:20])[N:12]2[c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[cH:6][cH:7][cH:8]1)[C:51]([CH2:50][O:49][CH2:48][CH2:47][O:46][CH2:45][C:43]([NH:42][CH2:41][CH2:40][O:39][CH2:38][CH2:37][O:36][CH2:35][C:34]([CH:33]([OH:32])[CH:55]([CH:56]([CH:57]([CH2:58][OH:59])[OH:60])[OH:61])[OH:62])=[O:54])=[O:44])=[O:52]Participants
6
Reactant 5
HCID 6228Dimethylformamide
HCID 12734Diisopropylcarbodiimide
HCID 222520374-(3-Aminomethylphenyl)-1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-hydroxypropyl]azetidin-2-one
HCID 22252049[2-({2-[2-(3,4,5,6,7-Pentahydroxy-2-oxoheptyloxy)ethoxy]ethylcarbamoyl}methoxy)ethoxy]acetic acid
HCID 178418300HCID 178418300, compoundProduct 1
Sources & evidence
- ORD record
- ord-2b34c1fb96754d688c3c032026f3390d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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