(2S)-2-[3-(2,5-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid
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![(2S)-2-[3-(2,5-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/634d5d655ac5448881bbc3668ae394c6.png "(2S)-2-[3-(2,5-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid")
(2S)-2-[3-(2,5-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid
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CAS No:
956049-35-7
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Formula:
C27H27NO6S
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Chemical Name:
(2S)-2-[3-(2,5-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid
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Synonyms:
ZINC2119626;STL529726;AKOS030502936;MCULE-3596439338;N-[3-(2,5-dimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanoyl]-L-methionine;(S)-2-(3-(2,5-dimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamido)-4-(methylthio)butanoic acid;956049-35-7
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CAS No:
(2S)-2-[3-(2,5-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid Basic Attributes
493.6 g/mol
493.15590875 g/mol
Computed Properties
Molecular Weight:493.6
XLogP3:4.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:493.15590875
Monoisotopic Mass:493.15590875
Topological Polar Surface Area:131
Heavy Atom Count:35
Complexity:838
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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