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Amb21918094

Duplicate ID
Molecule Name (2S,3S)-2-((S)-2-(2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)-3-phenylpropanamido)-3-hydroxybutanoic acid
SmilesCC(O)[C@H](NC(=O)[C@H](Cc1ccccc1)N1C(=O)Nc2ccccc2C1=O)C(O)=O
InchiKeyQWTFHQXHNZCQBF-XZNKJRRYSA-N
InChi InChI=1S/C21H21N3O6/c1-12(25)17(20(28)29)23-18(26)16(11-13-7-3-2-4-8-13)24-19(27)14-9-5-6-10-15(14)22-21(24)30/h2-10,12,16-17,25H,11H2,1H3,(H,22,30)(H,23,26)(H,28,29)/t12?,16-,17-/m0/s1
Formula C21H21N3O6
Molecular weight 411.408
Rings 3
logP 0.8147
PSA 141.49
MR 109.355
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