(2R)-3-benzylsulfanyl-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid
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![(2R)-3-benzylsulfanyl-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/425abd8a331a43a4827ff57420bc8d29.png "(2R)-3-benzylsulfanyl-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid")
(2R)-3-benzylsulfanyl-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid
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CAS No:
956041-93-3
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Formula:
C24H25NO7S
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Chemical Name:
(2R)-3-benzylsulfanyl-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid
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Synonyms:
ZINC2160577;STL532161;AKOS030503510;MCULE-2666323547;S-benzyl-N-[(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-L-cysteine;(R)-3-(benzylthio)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)propanoic acid;956041-93-3
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CAS No:
(2R)-3-benzylsulfanyl-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid Basic Attributes
471.5 g/mol
471.13517331 g/mol
Computed Properties
Molecular Weight:471.5
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:471.13517331
Monoisotopic Mass:471.13517331
Topological Polar Surface Area:137
Heavy Atom Count:33
Complexity:749
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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