(2R)-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]-3-methylsulfanylpropanoic acid
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![(2R)-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]-3-methylsulfanylpropanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f12c2c5e564b439dbefe8c3514168d38.png "(2R)-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]-3-methylsulfanylpropanoic acid")
(2R)-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]-3-methylsulfanylpropanoic acid
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CAS No:
956042-87-8
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Formula:
C20H19NO6S
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Chemical Name:
(2R)-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]-3-methylsulfanylpropanoic acid
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Synonyms:
ZINC2114729;STL533999;AKOS030502166;MCULE-5272534393;S-methyl-N-{[(4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy]acetyl}-L-cysteine;(R)-2-(2-((4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy)acetamido)-3-(methylthio)propanoic acid;956042-87-8
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CAS No:
(2R)-2-[[2-(4-methyl-6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]-3-methylsulfanylpropanoic acid Basic Attributes
401.4 g/mol
401.09330850 g/mol
Computed Properties
Molecular Weight:401.4
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:401.09330850
Monoisotopic Mass:401.09330850
Topological Polar Surface Area:127
Heavy Atom Count:28
Complexity:599
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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