(2S)-2-[[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]-4-methylsulfanylbutanoic acid
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![(2S)-2-[[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]-4-methylsulfanylbutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/77caf4de58f449968dfb585a6a6b26be.png "(2S)-2-[[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]-4-methylsulfanylbutanoic acid")
(2S)-2-[[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]-4-methylsulfanylbutanoic acid
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CAS No:
863247-97-6
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Formula:
C20H21NO6S
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Chemical Name:
(2S)-2-[[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]-4-methylsulfanylbutanoic acid
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Synonyms:
ZINC2099315;AKOS030498647;MCULE-8114226211;(S)-2-(2-(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetamido)-4-(methylthio)butanoic acid;863247-97-6
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CAS No:
(2S)-2-[[2-(3,5-dimethyl-7-oxofuro[3,2-g]chromen-6-yl)acetyl]amino]-4-methylsulfanylbutanoic 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:7
Exact Mass:403.10895856
Monoisotopic Mass:403.10895856
Topological Polar Surface Area:131
Heavy Atom Count:28
Complexity:678
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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