(2S,3S)-3-methyl-2-[[2-[[2-(3,4,7-trimethyl-2-oxochromen-5-yl)oxyacetyl]amino]acetyl]amino]pentanoic acid
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![(2S,3S)-3-methyl-2-[[2-[[2-(3,4,7-trimethyl-2-oxochromen-5-yl)oxyacetyl]amino]acetyl]amino]pentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8be5a58b712a4458ab51ea47048f79e2.png "(2S,3S)-3-methyl-2-[[2-[[2-(3,4,7-trimethyl-2-oxochromen-5-yl)oxyacetyl]amino]acetyl]amino]pentanoic acid")
(2S,3S)-3-methyl-2-[[2-[[2-(3,4,7-trimethyl-2-oxochromen-5-yl)oxyacetyl]amino]acetyl]amino]pentanoic acid
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CAS No:
956048-25-2
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Formula:
C22H28N2O7
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Chemical Name:
(2S,3S)-3-methyl-2-[[2-[[2-(3,4,7-trimethyl-2-oxochromen-5-yl)oxyacetyl]amino]acetyl]amino]pentanoic acid
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Synonyms:
ZINC2125393;AKOS032428219;MCULE-4542774151;(2S,3S)-3-methyl-2-(2-(2-((3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy)acetamido)acetamido)pentanoic acid;956048-25-2
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CAS No:
(2S,3S)-3-methyl-2-[[2-[[2-(3,4,7-trimethyl-2-oxochromen-5-yl)oxyacetyl]amino]acetyl]amino]pentanoic acid Basic Attributes
432.5 g/mol
432.18965124 g/mol
Computed Properties
Molecular Weight:432.5
XLogP3:2.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:432.18965124
Monoisotopic Mass:432.18965124
Topological Polar Surface Area:131
Heavy Atom Count:31
Complexity:748
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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