(2S)-2-[[2-[(2-methylphenyl)methyl]-3-sulfanylpropanoyl]amino]-4-methylsulfanylbutanoic acid
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![(2S)-2-[[2-[(2-methylphenyl)methyl]-3-sulfanylpropanoyl]amino]-4-methylsulfanylbutanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/5bcbeffa6d99451794546f211a686de9.png "(2S)-2-[[2-[(2-methylphenyl)methyl]-3-sulfanylpropanoyl]amino]-4-methylsulfanylbutanoic acid")
(2S)-2-[[2-[(2-methylphenyl)methyl]-3-sulfanylpropanoyl]amino]-4-methylsulfanylbutanoic acid
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CAS No:
145775-14-0
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Formula:
C16H23NO3S2
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Chemical Name:
(2S)-2-[[2-[(2-methylphenyl)methyl]-3-sulfanylpropanoyl]amino]-4-methylsulfanylbutanoic acid
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Synonyms:
CGS 26129;CGS 26129, (S)-isomer;CGS-26129;N-(2(S)-(mercaptomethyl)-3-(2-methylphenyl)-1-oxopropyl)-L-methionine;N-(3-mercapto-2-((2-methylphenyl)methyl)-1-oxopropyl)methionine;Sch 42354;Sch-42354;Cgs 26129;145775-14-0;NEP-IN-2;Cgs-26129;(3-mercapto-2-(2-methylbenzyl)propanoyl)-L-methionine;Sch 42354;SCHEMBL392068;DTXSID90932689;N-(3-Mercapto-2-((2-methylphenyl)methyl)-1-oxopropyl)methionine;HY-U00336;N-(2(S)-(Mercaptomethyl)-3-(2-methylphenyl)-1-oxopropyl)-L-methionine;CS-7368;(2S)-2-[[2-[(2-methylphenyl)methyl]-3-sulfanylpropanoyl]amino]-4-methylsulfanylbutanoic acid;L-Methionine, N-(2-(mercaptomethyl)-3-(2-methylphenyl)-1-oxopropyl)-;N-{1-Hydroxy-2-[(2-methylphenyl)methyl]-3-sulfanylpropylidene}methionine;(2S)-2-(3-Mercapto-2-(2-methylbenzyl)propanamido)-4-(methylthio)butanoic acid
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CAS No:
(2S)-2-[[2-[(2-methylphenyl)methyl]-3-sulfanylpropanoyl]amino]-4-methylsulfanylbutanoic acid Basic Attributes
341.5 g/mol
341.11193594 g/mol
Computed Properties
Molecular Weight:341.5
XLogP3:2.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:341.11193594
Monoisotopic Mass:341.11193594
Topological Polar Surface Area:92.7
Heavy Atom Count:22
Complexity:365
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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