(2R)-3-benzylsulfanyl-2-[[2-(3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid
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![(2R)-3-benzylsulfanyl-2-[[2-(3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ba26171256da408987e1f3969654db01.png "(2R)-3-benzylsulfanyl-2-[[2-(3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid")
(2R)-3-benzylsulfanyl-2-[[2-(3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid
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CAS No:
956047-49-7
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Formula:
C23H23NO6S
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Chemical Name:
(2R)-3-benzylsulfanyl-2-[[2-(3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid
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Synonyms:
ZINC2160478;STL533121;AKOS030503492;MCULE-8147688999;S-benzyl-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-L-cysteine;(R)-3-(benzylthio)-2-(2-((3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)propanoic acid;956047-49-7
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CAS No:
(2R)-3-benzylsulfanyl-2-[[2-(3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid Basic Attributes
441.5 g/mol
441.12460863 g/mol
Computed Properties
Molecular Weight:441.5
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:441.12460863
Monoisotopic Mass:441.12460863
Topological Polar Surface Area:127
Heavy Atom Count:31
Complexity:702
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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