(2S)-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-4-methylsulfanylbutanoic acid
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![(2S)-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-4-methylsulfanylbutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8af91c012d2947d9b9e5a6e9c35182f8.png "(2S)-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-4-methylsulfanylbutanoic acid")
(2S)-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-4-methylsulfanylbutanoic acid
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CAS No:
956382-77-7
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Formula:
C19H23NO7S
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Chemical Name:
(2S)-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-4-methylsulfanylbutanoic acid
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Synonyms:
ZINC2120430;STL533150;AKOS030503136;MCULE-3634349006;N-[(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-L-methionine;(S)-2-(2-(6,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)-4-(methylthio)butanoic acid;956382-77-7
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CAS No:
(2S)-2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-4-methylsulfanylbutanoic acid Basic Attributes
409.5 g/mol
409.11952325 g/mol
Computed Properties
Molecular Weight:409.5
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:409.11952325
Monoisotopic Mass:409.11952325
Topological Polar Surface Area:137
Heavy Atom Count:28
Complexity:636
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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