(2S)-4-methylsulfanyl-2-[[2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxyacetyl]amino]butanoic acid
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![(2S)-4-methylsulfanyl-2-[[2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxyacetyl]amino]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/05e8625b2edb4a9b82970798491c0a67.png "(2S)-4-methylsulfanyl-2-[[2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxyacetyl]amino]butanoic acid")
(2S)-4-methylsulfanyl-2-[[2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxyacetyl]amino]butanoic acid
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CAS No:
956044-23-8
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Formula:
C19H23NO6S
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Chemical Name:
(2S)-4-methylsulfanyl-2-[[2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxyacetyl]amino]butanoic acid
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Synonyms:
N-{[(3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-L-methionine;ZINC2146301;STL460765;AKOS004937670;MCULE-3288302885;(S)-4-(methylthio)-2-(2-((3,4,8-trimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid;956044-23-8
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CAS No:
(2S)-4-methylsulfanyl-2-[[2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxyacetyl]amino]butanoic acid Basic Attributes
393.5 g/mol
393.12460863 g/mol
Computed Properties
Molecular Weight:393.5
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:393.12460863
Monoisotopic Mass:393.12460863
Topological Polar Surface Area:127
Heavy Atom Count:27
Complexity:619
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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