(2R)-3-benzylsulfanyl-2-[[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid
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![(2R)-3-benzylsulfanyl-2-[[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/1581c0a0b9ee497f8464e57de61324a1.png "(2R)-3-benzylsulfanyl-2-[[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid")
(2R)-3-benzylsulfanyl-2-[[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid
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CAS No:
863248-00-4
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Formula:
C25H23NO6S
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Chemical Name:
(2R)-3-benzylsulfanyl-2-[[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid
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Synonyms:
ZINC2099059;EiM07-28599;AKOS030498611;MCULE-3290045490;863248-00-4
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CAS No:
(2R)-3-benzylsulfanyl-2-[[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]propanoic acid Basic Attributes
465.5 g/mol
465.12460863 g/mol
Computed Properties
Molecular Weight:465.5
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:465.12460863
Monoisotopic Mass:465.12460863
Topological Polar Surface Area:131
Heavy Atom Count:33
Complexity:792
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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