(2S)-3-methyl-2-[[2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]butanoic acid
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![(2S)-3-methyl-2-[[2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/5eb81b80209041d49bb2225899c9d0d3.png "(2S)-3-methyl-2-[[2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]butanoic acid")
(2S)-3-methyl-2-[[2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]butanoic acid
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CAS No:
956047-56-6
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Formula:
C23H25NO6
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Chemical Name:
(2S)-3-methyl-2-[[2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]butanoic acid
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Synonyms:
ZINC2156926;AKOS030499339;MCULE-8734831727;(S)-3-methyl-2-(2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)acetamido)butanoic acid;956047-56-6
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CAS No:
(2S)-3-methyl-2-[[2-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)acetyl]amino]butanoic acid Basic Attributes
411.4 g/mol
411.16818752 g/mol
Computed Properties
Molecular Weight:411.4
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:411.16818752
Monoisotopic Mass:411.16818752
Topological Polar Surface Area:106
Heavy Atom Count:30
Complexity:759
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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