(2S)-2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid
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![(2S)-2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3d4a2598569f45a091d6715818a230d8.png "(2S)-2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid")
(2S)-2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid
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CAS No:
956706-84-6
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Formula:
C23H23NO8
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Chemical Name:
(2S)-2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid
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Synonyms:
ZINC2158839;STL533144;AKOS030503239;MCULE-2451786188;N-[(5,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-L-tyrosine;(S)-2-(2-(5,7-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)-3-(4-hydroxyphenyl)propanoic acid;956706-84-6
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CAS No:
(2S)-2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid Basic Attributes
441.4 g/mol
441.14236669 g/mol
Computed Properties
Molecular Weight:441.4
XLogP3:2.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:441.14236669
Monoisotopic Mass:441.14236669
Topological Polar Surface Area:131
Heavy Atom Count:32
Complexity:742
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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