(2R)-3-benzylsulfanyl-2-[3-(7-methoxy-4,8-dimethyl-2-oxochromen-3-yl)propanoylamino]propanoic acid
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![(2R)-3-benzylsulfanyl-2-[3-(7-methoxy-4,8-dimethyl-2-oxochromen-3-yl)propanoylamino]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/1fb0d86a730541c88384fd93e90434fb.png "(2R)-3-benzylsulfanyl-2-[3-(7-methoxy-4,8-dimethyl-2-oxochromen-3-yl)propanoylamino]propanoic acid")
(2R)-3-benzylsulfanyl-2-[3-(7-methoxy-4,8-dimethyl-2-oxochromen-3-yl)propanoylamino]propanoic acid
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CAS No:
956962-28-0
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Formula:
C25H27NO6S
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Chemical Name:
(2R)-3-benzylsulfanyl-2-[3-(7-methoxy-4,8-dimethyl-2-oxochromen-3-yl)propanoylamino]propanoic acid
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Synonyms:
ZINC2096737;EiM07-20368;AKOS030498228;MCULE-3466553835;956962-28-0
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CAS No:
(2R)-3-benzylsulfanyl-2-[3-(7-methoxy-4,8-dimethyl-2-oxochromen-3-yl)propanoylamino]propanoic acid Basic Attributes
469.6 g/mol
469.15590875 g/mol
Computed Properties
Molecular Weight:469.6
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:469.15590875
Monoisotopic Mass:469.15590875
Topological Polar Surface Area:127
Heavy Atom Count:33
Complexity:747
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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