(2S,3R)-2-[[2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid
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![(2S,3R)-2-[[2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d56757a19f98446ea089e02b3b2b0ef4.png "(2S,3R)-2-[[2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid")
(2S,3R)-2-[[2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid
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CAS No:
956047-47-5
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Formula:
C22H28N2O8
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Chemical Name:
(2S,3R)-2-[[2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid
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Synonyms:
ZINC2160568;EiM07-29524;AKOS030503509;MCULE-1938406110;956047-47-5
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CAS No:
(2S,3R)-2-[[2-[[2-(5,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]acetyl]amino]-3-methylpentanoic acid Basic Attributes
448.5 g/mol
448.18456586 g/mol
Computed Properties
Molecular Weight:448.5
XLogP3:1.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:448.18456586
Monoisotopic Mass:448.18456586
Topological Polar Surface Area:140
Heavy Atom Count:32
Complexity:765
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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