(2S)-4-methylsulfanyl-2-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]butanoic acid
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![(2S)-4-methylsulfanyl-2-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6e7f56b526ae4b398197ab62f0bdfd91.png "(2S)-4-methylsulfanyl-2-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]butanoic acid")
(2S)-4-methylsulfanyl-2-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]butanoic acid
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CAS No:
956045-43-5
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Formula:
C22H25NO6S
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Chemical Name:
(2S)-4-methylsulfanyl-2-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]butanoic acid
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Synonyms:
ZINC2096613;STL529348;AKOS030498205;MCULE-6756891993;N-[(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-L-methionine;(S)-4-(methylthio)-2-(2-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetamido)butanoic acid;956045-43-5
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CAS No:
(2S)-4-methylsulfanyl-2-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]butanoic acid Basic Attributes
431.5 g/mol
431.14025869 g/mol
Computed Properties
Molecular Weight:431.5
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:431.14025869
Monoisotopic Mass:431.14025869
Topological Polar Surface Area:131
Heavy Atom Count:30
Complexity:737
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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