(2S)-2-amino-5-[[(2R)-2-amino-3-(2-chloro-4-nitrophenyl)sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid
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![(2S)-2-amino-5-[[(2R)-2-amino-3-(2-chloro-4-nitrophenyl)sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/173cddbcdf544fdeb134654eaf807d41.png "(2S)-2-amino-5-[[(2R)-2-amino-3-(2-chloro-4-nitrophenyl)sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid")
(2S)-2-amino-5-[[(2R)-2-amino-3-(2-chloro-4-nitrophenyl)sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid
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CAS No:
305-60-2
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Formula:
C16H19ClN4O8S
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Chemical Name:
(2S)-2-amino-5-[[(2R)-2-amino-3-(2-chloro-4-nitrophenyl)sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid
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Synonyms:
S-(2-chloro-4-nitrophenyl)glutathione;305-60-2;S-(2-Chloro-4-nitrophenyl)glutathione;DTXSID80952816;S-(2-Chloro-4-nitrophenyl)cysteinyl-N-gamma-glutamylglycine;N-(S-(2-Chloro-4-nitrophenyl)-N-L-gamma-glutamyl- L-cysteinyl)glycine
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CAS No:
(2S)-2-amino-5-[[(2R)-2-amino-3-(2-chloro-4-nitrophenyl)sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid Basic Attributes
462.9 g/mol
462.0612124 g/mol
Computed Properties
Molecular Weight:462.9
XLogP3:-4.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:10
Exact Mass:462.0612124
Monoisotopic Mass:462.0612124
Topological Polar Surface Area:235
Heavy Atom Count:30
Complexity:676
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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