(2R)-3-methylsulfanyl-2-[[2-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid
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![(2R)-3-methylsulfanyl-2-[[2-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/56a116bd00a446a480a122be33ce0b63.png "(2R)-3-methylsulfanyl-2-[[2-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid")
(2R)-3-methylsulfanyl-2-[[2-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid
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CAS No:
956691-77-3
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Formula:
C20H21NO6S
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Chemical Name:
(2R)-3-methylsulfanyl-2-[[2-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid
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Synonyms:
ZINC2122423;STL530798;AKOS030503871;MCULE-6946471925;S-methyl-N-[(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-L-cysteine;956691-77-3
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CAS No:
(2R)-3-methylsulfanyl-2-[[2-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid Basic Attributes
403.5 g/mol
403.10895856 g/mol
Computed Properties
Molecular Weight:403.5
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:403.10895856
Monoisotopic Mass:403.10895856
Topological Polar Surface Area:131
Heavy Atom Count:28
Complexity:692
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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