(2S)-2-[[2-(3-hexyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-methylbutanoic acid
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(2S)-2-[[2-(3-hexyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-methylbutanoic acid
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CAS No:
957042-75-0
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Formula:
C23H31NO6
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Chemical Name:
(2S)-2-[[2-(3-hexyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-methylbutanoic acid
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Synonyms:
ZINC2129691;EiM07-17066;STL460800;AKOS016357304;MCULE-2332122313;N-{[(3-hexyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-L-valine;(2S)-2-({2-[(3-hexyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}amino)-3-methylbutanoic acid;957042-75-0
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CAS No:
(2S)-2-[[2-(3-hexyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-methylbutanoic acid Basic Attributes
417.5 g/mol
417.21513771 g/mol
Computed Properties
Molecular Weight:417.5
XLogP3:5.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:11
Exact Mass:417.21513771
Monoisotopic Mass:417.21513771
Topological Polar Surface Area:102
Heavy Atom Count:30
Complexity:656
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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