(2S)-2-[3-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid
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![(2S)-2-[3-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8c9e3d4569f34176aeec866656eeba69.png "(2S)-2-[3-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid")
(2S)-2-[3-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid
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CAS No:
956683-97-9
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Formula:
C24H29NO6S
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Chemical Name:
(2S)-2-[3-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid
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Synonyms:
ZINC2118350;EiM07-29325;AKOS030502729;MCULE-3393889794;956683-97-9
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CAS No:
(2S)-2-[3-(3-tert-butyl-5-methyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoic acid Basic Attributes
459.6 g/mol
459.17155882 g/mol
Computed Properties
Molecular Weight:459.6
XLogP3:4.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:459.17155882
Monoisotopic Mass:459.17155882
Topological Polar Surface Area:131
Heavy Atom Count:32
Complexity:773
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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