(2R)-3-methylsulfanyl-2-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid
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![(2R)-3-methylsulfanyl-2-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/dd536aee1bba45df862a612239634872.png "(2R)-3-methylsulfanyl-2-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid")
(2R)-3-methylsulfanyl-2-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid
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CAS No:
956043-90-6
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Formula:
C21H23NO6S
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Chemical Name:
(2R)-3-methylsulfanyl-2-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid
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Synonyms:
ZINC2117367;STL532590;AKOS030502508;MCULE-4114899361;S-methyl-N-[(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-L-cysteine;956043-90-6
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CAS No:
(2R)-3-methylsulfanyl-2-[[2-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid Basic Attributes
417.5 g/mol
417.12460863 g/mol
Computed Properties
Molecular Weight:417.5
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:417.12460863
Monoisotopic Mass:417.12460863
Topological Polar Surface Area:131
Heavy Atom Count:29
Complexity:722
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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